Paraben

Paraben

SCHEMBL1756187

O.O=C(O)c1ccc(O)cc1

nearest known ligand 0.94

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ABCC9ABL1ACEACHEACVR1ADORA1ADORA2AADORA2BADORA3ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3AGTR1ALOX5ATP4AATP4BBCRBTKCACNA1ACACNA1BCACNA1CCACNA1DCACNA1ECACNA1FCACNA1GCACNA1HCACNA1ICACNA1SCACNA2D1CACNA2D2CACNA2D3CACNA2D4CACNB1CACNB2CACNB3CACNB4CACNG1CACNG2CACNG3CACNG4CACNG5CACNG6CACNG7CACNG8CALCRLCFBCHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNB1CHRNDCHRNECHRNGCRBNCUL4ACXCR1CXCR2DDB1DDCDHFRDPP4DRD2DRD3DRD4EGFRERBB2ERBB4ESR1ESR2FDPSFKBP1AFLT1FLT3FLT4GARTGHSRGRIA1GRIA2GRIA3GRIA4GRIK1GRIK2GRIK3GRIK4GRIK5GRIN2AGSK3AGSK3BHDAC1HDAC10HDAC11HDAC2HDAC3HDAC4HDAC5HDAC6HDAC7HDAC8HDAC9HRH1HTR1AHTR1BHTR1DHTR1EHTR1FHTR2AHTR2BHTR2CHTR3AHTR3BHTR3CHTR3DHTR3EHTR4HTR5AHTR6HTR7IDH1IDH2IMPA1ITGA2BITGB3JAK1JAK2JAK3KCNJ11KCNK3KCNK9KDRKITMEN1METMMP1MMP13MMP7MMP8NANOD2NS5bODC1OPG057OPRD1OPRK1OPRM1PPARP1PARP2PDE3APDE3BPDE4APDE4BPDE4CPDE4DPDGFRBPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PKLRPPARDPPATPTGS1PTGS2RBX1ROCK1ROCK2RRM1RRM2RRM2BSCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASCNN1ASCNN1BSCNN1GSIGMAR1SLC10A2SLC5A2SLC6A2SLC6A3SLC6A4SLC9A3SYKTACR1THRATHRBTOP1TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYK2TYMSVDRampCblablaT-3blaT-4blaT-5blaT-6blaUOE-1dacAdacBdacCfolAfolPftsIgyrAgyrBileSmecAmrcAmrcBmrdAparCparEpbp2pbp4pbpApbpFrplArplBrplCrplDrplErplFrplIrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmE2rpmFrpmGrpmG1rpmG2rpmG3rpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUthyAykgMykgO

The experimentally established mechanism targets of Paraben. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ESR1 known ✓ P03372 1/20 0.60
▸ ESR2 known ✓ Q92731 1/20 0.60
▸ CA2 P00918 4/20 0.94
▸ CA1 P00915 3/20 0.94
▸ CA12 O43570 1/20 0.94
▸ CA3 P07451 1/20 0.94
▸ TYR P14679 1/20 0.94
▸ DRD1 P21728 1/20 0.94
▸ CA4 P22748 1/20 0.94
▸ CA6 P23280 1/20 0.94
▸ CA5A P35218 1/20 0.94
▸ CA7 P43166 1/20 0.94
▸ CA9 Q16790 1/20 0.94
▸ CA14 Q9ULX7 1/20 0.94
▸ CA5B Q9Y2D0 1/20 0.94
▸ SRD5A2 P31213 3/20 0.80
▸ TSHR P16473 3/20 0.71
▸ TP53 P04637 1/20 0.71
▸ LMNA P02545 1/20 0.60
▸ MAPT P10636 1/20 0.60

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Paraben SCHEMBL1756156 1.00 CA2 (0.94) CA2CA1CA12CA3TYR
Paraben SCHEMBL7622776 0.97 CA2 (1.00) CA2CA1CA12CA3TYR
Terephthalic Acid SCHEMBL6692916 0.97 CA2 (1.00) CA2CA1CA12CA3TYR
Paraben SCHEMBL20500516 0.97 CA2 (1.00) CA2CA1CA12CA3TYR
Paraben SCHEMBL5311518 0.97 CA2 (1.00) CA2CA1CA12CA3TYR
Terephthalic Acid SCHEMBL3460105 0.97 CA2 (1.00) CA2CA1CA12CA3TYR
Paraben SCHEMBL3212865 0.97 CA2 (1.00) CA2CA1CA12CA3TYR
Paraben SCHEMBL4110 0.97 CA2 (1.00) CA2CA1CA12CA3TYR
Paraben SCHEMBL15948949 0.95 CA2 (0.84) CA2CA1CA12CA3TYR
Paraben SCHEMBL15948950 0.95 CA2 (0.84) CA2CA1CA12CA3TYR

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 42 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104628677-A Crystal forms of vortioxetine organic acid salt and preparation method thereof UNIV ZHEJIANG 2015-05-20 — — CN claimed
US-20130217911-A1 Method For Producing Acyloxy Benzoic Acids CLARIANT FINANCE (BVI) LIMITED (VG) 2013-08-22 — — US claimed
EP-0637587-B1 Bicyclic beta-lactam/paraben complexes LILLY CO ELI (US) 1997-11-05 — — EP claimed
EP-0637587-A1 Bicyclic beta-lactam/paraben complexes ELI LILLY AND COMPANY (US) 1995-02-08 — — EP claimed
US-20250283016-A1 Polypeptides Having Beta-Glucanase Activity, Polynucleotides Encoding Same and Uses Thereof In Cleaning and Detergent Compositions NOVOZYMES A/S (DK) 2025-09-11 — — US disclosed
CN-113785039-B Polypeptides having beta-glucanase activity, polynucleotides encoding same and use thereof in cleaning and detergent compositions 诺维信公司 2024-06-18 — — CN disclosed
US-20220169953-A1 POLYPEPTIDES HAVING BETA-GLUCANASE ACTIVITY, POLYNUCLEOTIDES ENCODING SAME AND USES THEREOF IN CLEANING AND DETERGENT COMPOSITIONS NOVOZYMES A/S (DK) 2022-06-02 — — US disclosed
CN-113785039-A Polypeptides having beta-glucanase activity, polynucleotides encoding same and use thereof in cleaning and detergent compositions 诺维信公司 2021-12-10 — — CN disclosed
WO-2021033729-A1 SALT AND CRYSTAL FORM OF COMPOUND HAVING AGONISTIC ACTIVITY TO S1P5 RECEPTOR 小野薬品工業株式会社 2021-02-25 — — WO disclosed
US-9173391-B2 Crystalline complexes of 4-hydroxy benzoic acid and selected pesticides BASF SE (DE) 2015-11-03 — — US disclosed
EP-1614673-B1 CRYSTAL OF p-HYDROXYBENZOIC ACID AND PROCESS FOR PRODUCING THE SAME UENO FINE CHEMICAL IND (JP) 2015-10-28 — — EP disclosed
CN-104628677-A Crystal forms of vortioxetine organic acid salt and preparation method thereof UNIV ZHEJIANG 2015-05-20 — — CN disclosed
US-20020098518-A1 Rapid identification of conditions, compounds, or compositions that inhibit, prevent, induce, modify, or reverse transitions of physical state LEVINSON DOUGLAS (US) 2002-07-25 — — US disclosed
WO-2002044730-A1 RAPID IDENTIFICATION OF CONDITIONS, COMPOUNDS, OR COMPOSITIONS THAT INHIBIT, PREVENT, INDUCE, MODIFY, OR REVERSE TRANSITIONS OF PHYSICAL STATE TRANSFORM PHARMACEUTICALS, INC. (US) 2002-06-06 — — WO disclosed
US-20020048610-A1 High-throughput formation, identification, and analysis of diverse solid-forms MILLENNIUM PHARMACEUTICALS, INC. 2002-04-25 — — US disclosed
WO-2001051919-A9 HIGH-THROUGHPUT FORMATION, IDENTIFICATION, AND ANALYSIS OF DIVERSE SOLID-FORMS TRANSFORM PHARMACEUTICALS INC (US) 2002-03-14 — — WO disclosed
WO-2001051919-A2 HIGH-THROUGHPUT FORMATION, IDENTIFICATION, AND ANALYSIS OF DIVERSE SOLID-FORMS TRANSFORM PHARMACEUTICALS, INC. (US) 2001-07-19 — — WO disclosed
EP-0910249-A1 RECTAL PLUG AND METHOD OF INTRODUCING SAME INTO A SLAUGHTERED ANIMAL StarchTech, Inc. (US) 1999-04-28 — — EP disclosed
EP-0910249-A4 — — 1999-04-28 — — EP disclosed
WO-1996037110-A1 RECTAL PLUG AND METHOD OF INTRODUCING SAME INTO A SLAUGHTERED ANIMAL ANDERBERG STEVEN L (US) 1996-11-28 — — WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20130217911-A1 Method For Producing Acyloxy Benzoic Acids ACOX1, PAH, FAAH ESR1 749/4885ESR2 1492/4885CA2 312/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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