SCHEMBL5115273

SCHEMBL5115273

Cc1ccc(S(=O)(=O)O)cc1.NC(Cc1ccc(O)cc1)C(=O)OCc1ccccc1

nearest known ligand 0.48

Known targets — ChEMBL curated mechanism

ABL1BMXBRAFBTKCHRNA4CHRNB2CSNK1EEGFRERBB2F10FLT1FLT3FLT4IGF1RINSRITKJAK3KDRKITOPRM1PARP1PARP2PDGFRBPIK3CDRAF1RETSLC18A2TECTXKdacAdacBdacCftsImrcAmrcBmrdArplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of None. 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
MAPT P10636 1/20 0.48
LMNA P02545 1/20 0.48
SLC7A5 Q01650 2/20 0.45
CYP1A2 P05177 1/20 0.43
CYP2C9 P11712 1/20 0.43
ERAP2 Q6P179 1/20 0.42
LNPEP Q9UIQ6 1/20 0.42
SLC15A1 P46059 1/20 0.42
LTA4H P09960 1/20 0.42
LAP3 P28838 1/20 0.42
P2RX7 Q99572 2/20 0.42
TYR P14679 2/20 0.42
CA1 P00915 2/20 0.41
CA2 P00918 2/20 0.41
TACR1 P25103 1/20 0.41
GAA P10253 1/20 0.41
CYP2D6 P10635 1/20 0.41
MAPK1 P28482 1/20 0.41
ALDH1A1 P00352 1/20 0.40
ALPI P09923 1/20 0.40

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
SCHEMBL12615481 1.00 MAPT (0.48) MAPTLMNASLC7A5CYP1A2CYP2C9
SCHEMBL716533 1.00 MAPT (0.48) MAPTLMNASLC7A5CYP1A2CYP2C9
SCHEMBL2590490 0.95 LMNA (0.52) MAPTLMNASLC7A5CYP1A2CYP2C9
SCHEMBL718199 0.95 LMNA (0.52) MAPTLMNASLC7A5CYP1A2CYP2C9
SCHEMBL5221398 0.95 LMNA (0.52) MAPTLMNASLC7A5CYP1A2CYP2C9
SCHEMBL8813869 0.91 P2RX7 (0.47) MAPTLMNACYP1A2CYP2C9SLC15A1
SCHEMBL6895557 0.91 ALDH1A1 (0.50) MAPTLMNACYP1A2CYP2C9SLC15A1
SCHEMBL8813866 0.91 P2RX7 (0.47) MAPTLMNACYP1A2CYP2C9SLC15A1
SCHEMBL7302285 0.90 LTA4H (0.56) MAPTLMNALNPEPLTA4HLAP3
SCHEMBL27403149 0.90 MMP1 (0.46) MAPTLMNALTA4HLAP3P2RX7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240148721-A1 DISCRETE PEG CONSTRUCTS AUDAX PRIVATE DEBT LLC, AS AGENT 2024-05-09 US disclosed
CN-110637007-B9 Synthesis of tyrosine-derived diphenol monomers 美敦力公司 2023-08-15 CN disclosed
CN-110637007-B Synthesis of tyrosine-derived diphenol monomers 美敦力公司 2023-06-16 CN disclosed
EP-3634944-B1 SYNTHESIS OF TYROSINE DERIVED DIPHENOL MONOMERS MEDTRONIC INC (US) 2022-06-29 EP disclosed
CN-110015978-B Synthesis method of O- [2- [ [ (tert-butyloxycarbonyl) amino ] ethyl ] -N- [ fluorenylmethoxycarbonyl ] -L-tyrosine 康化(上海)新药研发有限公司 2021-03-19 CN disclosed
US-10786497-B2 Discrete PEG constructs EQUIP, LLC (US) 2020-09-29 US disclosed
US-20200230133-A1 Discrete PEG Constructs EqIP, LLC (US) 2020-07-23 US disclosed
EP-3634944-A1 SYNTHESIS OF TYROSINE DERIVED DIPHENOL MONOMERS Medtronic, Inc. (US) 2020-04-15 EP disclosed
CN-110637007-A Synthesis of tyrosine-derived diphenol monomers 美敦力公司 2019-12-31 CN disclosed
US-10442757-B2 Synthesis of tyrosine derived diphenol monomers MEDTRONIC, INC. (US) 2019-10-15 US disclosed
US-20040224955-A1 Viral polymerase inhibitors BOEHRINGER INGELHEIM (CANADA) LTD. (CA) 2004-11-11 US disclosed
US-6794404-B2 BENZIMIDAZOLE DERIVATIVES BOEHRINGER INGELHEIM (CANADA) LTD. (CA) 2004-09-21 US disclosed
US-20030232816-A1 Viral polymerase inhibitors BOEHRINGER INGELHEIM (CANADA) LTD. (CA) 2003-12-18 US disclosed
EP-1301487-A2 VIRAL POLYMERASE INHIBITORS BOEHRINGER INGELHEIM (CANADA) LTD. (CA) 2003-04-16 EP disclosed
US-6479508-B1 INHIBITOR OF RNA DEPENDENT RNA POLYMERASE ACTIVITY OF THE ENZYME NS5B ENCODED BY HEPATITIS C VIRUS FOR TREATMENT AND PREVENTION OF HEPATITIS C INFECTIONS BOEHRINGER INGELHEIM (CANADA) LTD. (CA) 2002-11-12 US disclosed
US-6448281-B1 INHIBITORS OF HEPATITIS C VIRUS REPLICATION; TREATMENT OF HEPATITIS C BOEHRINGER INGELHEIM (CANADA) LTD. (CA) 2002-09-10 US disclosed
US-20020065418-A1 Inhibitors of hepatitis C virus replication; treatment of hepatitis C BOEHRINGER INGELHEIM (CANADA) LTD. (CA) 2002-05-30 US disclosed
WO-2002004425-A2 VIRAL POLYMERASE INHIBITORS BOEHRINGER INGELHEIM (CANADA) LTD. (CA) 2002-01-17 WO disclosed
EP-0838471-A1 PEPTIDE DERIVATIVES AND ANGIOTENSIN IV RECEPTOR AGONIST SAGAMI CHEMICAL RESEARCH CENTER (JP) 1998-04-29 EP disclosed
CN-1156442-A Dimeric DTPA derivatives and metal complexes thereof, medicaments containing said complexes, their use in diagnosis and therapy and process for preparing said complexes and medicaments SCHERING AG (DE) 1997-08-06 CN 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 (7 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-10442757-B2 Synthesis of tyrosine derived diphenol monomers TYR, TH, TYRO3 MAPT 1403/4885LMNA 4273/4885SLC7A5 1220/4885
US-20240148721-A1 DISCRETE PEG CONSTRUCTS MUC1, EGFR, LNPEP MAPT 419/4885LMNA 1102/4885SLC7A5 1842/4885
US-10786497-B2 Discrete PEG constructs MUC1, EGFR, LNPEP MAPT 419/4885LMNA 1102/4885SLC7A5 1842/4885
US-20030232816-A1 Viral polymerase inhibitors POLR2H, POLR2E, POLM MAPT 3559/4885LMNA 1560/4885SLC7A5 1600/4885
US-20020065418-A1 Inhibitors of hepatitis C virus replication; treatment of hepatitis C HAVCR2, HCCS, ZC3HAV1 MAPT 4597/4885LMNA 2204/4885SLC7A5 838/4885
US-20200230133-A1 Discrete PEG Constructs MUC1, EGFR, LNPEP MAPT 419/4885LMNA 1102/4885SLC7A5 1842/4885
US-20040224955-A1 Viral polymerase inhibitors POLR2H, POLR2E, POLM MAPT 3559/4885LMNA 1560/4885SLC7A5 1600/4885

“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.