Metacresol

Metacresol

SCHEMBL15466197

CC(=O)O.Cc1cccc(O)c1

nearest known ligand 0.77

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADRA2AADRA2BADRA2CADRB2AGTR1AVPR1AAVPR1BAVPR2BDKRB2CALCRCHRNA3CHRNB4ESR1ESR2GHSRGNRHRGSC1HSPA8MALT1MC1RMC4RNOS1NOS2NOS3OPRK1OXTRRAMP1RAMP2RAMP3SCN5ASSTR1SSTR2SSTR3SSTR4SSTR5dacAdacBdacCfolPftsImrcAmrcBmrdArplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of Metacresol. 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
▸ ACHE P22303 2/20 0.77
▸ CYP1A2 P05177 2/20 0.52
▸ CYP2C19 P33261 1/20 0.52
▸ CA12 O43570 2/20 0.50
▸ CA2 P00918 2/20 0.50
▸ CA9 Q16790 2/20 0.50
▸ SMN1; SMN2 Q16637 1/20 0.50
▸ CA1 P00915 1/20 0.50
▸ CA6 P23280 1/20 0.50
▸ ALDH1A1 P00352 3/20 0.48
▸ CYP3A4 P08684 2/20 0.48
▸ LMNA P02545 2/20 0.48
▸ HSD17B10 Q99714 2/20 0.48
▸ CA5A P35218 1/20 0.48
▸ CA14 Q9ULX7 1/20 0.48
▸ CA5B Q9Y2D0 1/20 0.48
▸ GAA P10253 1/20 0.47
▸ PARP1 P09874 1/20 0.47
▸ MMP1 P03956 1/20 0.45
▸ MMP2 P08253 1/20 0.45

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
Metacresol SCHEMBL28339537 0.93 ACHE (0.81) ACHECYP1A2CYP2C19CA12CA2
Metacresol SCHEMBL1034095 0.93 ACHE (0.81) ACHECYP1A2CYP2C19CA12CA2
Metacresol SCHEMBL6234380 0.91 ACHE (0.94) ACHECYP1A2CYP2C19CA12CA2
Metacresol SCHEMBL10590589 0.89 ACHE (0.74) ACHECYP1A2CYP2C19CA12CA2
Metacresol SCHEMBL29352064 0.88 — —
Metacresol SCHEMBL9774388 0.88 ACHE (1.00) ACHECYP1A2CYP2C19CA12CA2
Metacresol SCHEMBL10736 0.88 — —
Metacresol SCHEMBL11437600 0.88 ACHE (1.00) ACHECYP1A2CYP2C19CA12CA2
Metacresol SCHEMBL2314567 0.88 ACHE (1.00) ACHECYP1A2CYP2C19CA12CA2
Metacresol SCHEMBL28191034 0.87 ACHE (0.71) ACHECYP1A2CYP2C19CA12CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107556201-B Process for preparing m-aminophenol 山西智创药研科技有限公司 2020-10-27 — — CN claimed
US-10224485-B2 Process for preparing a crystalline organic semiconductor material BASF SE (DE) 2019-03-05 — — US claimed
EP-3183250-B1 PROCESS FOR PREPARING CRYSTALLINE ORGANIC SEMICONDUCTOR MATERIAL CLAP CO LTD (KR) 2023-10-04 — — EP disclosed
EP-3183757-B1 ORGANIC SEMICONDUCTOR COMPOSITION COMPRISING LIQUID MEDIUM CLAP CO LTD (KR) 2022-05-04 — — EP disclosed
CN-113544245-A Biochemical production of sandalwood oil 弗门尼舍有限公司 2021-10-22 — — CN disclosed
CN-107556201-B Process for preparing m-aminophenol 山西智创药研科技有限公司 2020-10-27 — — CN disclosed
CN-107004768-B Organic semiconductor composition containing a liquid medium 巴斯夫欧洲公司 2020-08-21 — — CN disclosed
US-10454037-B2 Organic semiconductor composition comprising a liquid medium BASF SE (DE) 2019-10-22 — — US disclosed
US-10224485-B2 Process for preparing a crystalline organic semiconductor material BASF SE (DE) 2019-03-05 — — US disclosed
US-10043978-B2 Organic semiconductor formulations FLEXTERRA, INC. (US) 2018-08-07 — — US disclosed
US-20170250347-A1 ORGANIC SEMICONDUCTOR COMPOSITION COMPRISING A LIQUID MEDIUM BASF SE (DE) 2017-08-31 — — US disclosed
EP-3183250-A1 PROCESS FOR PREPARING CRYSTALLINE ORGANIC SEMICONDUCTOR MATERIAL BASF SE (DE) 2017-06-28 — — EP disclosed
EP-3183757-A1 ORGANIC SEMICONDUCTOR COMPOSITION COMPRISING LIQUID MEDIUM BASF SE (DE) 2017-06-28 — — EP disclosed
US-20170012208-A1 ORGANIC SEMICONDUCTOR FORMULATIONS USINVEST LLC 2017-01-12 — — US disclosed
US-9293711-B2 Organic semiconductor formulations POLYERA CORPORATION (US) 2016-03-22 — — US disclosed
WO-2016027218-A1 PROCESS FOR PREPARING CRYSTALLINE ORGANIC SEMICONDUCTOR MATERIAL BASF SE (DE) 2016-02-25 — — WO disclosed
WO-2016027217-A1 ORGANIC SEMICONDUCTOR COMPOSITION COMPRISING LIQUID MEDIUM BASF SE (DE) 2016-02-25 — — WO disclosed
US-20140042369-A1 Organic Semiconductor Formulations USINVEST LLC 2014-02-13 — — US disclosed
CN-1022601-C Plant mildew preventive for instruments HUNAN INST OF METERING & TEST (CN) 1993-11-03 — — CN disclosed
CN-1036689-A The botanical mildew inhibitor that instrument is used HUNAN INST OF METERING AND TES (CN) 1989-11-01 — — 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 (3 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-20170250347-A1 ORGANIC SEMICONDUCTOR COMPOSITION COMPRISING A LIQUID MEDIUM CRY1, NEFM, OR10J3 ACHE 3488/4885CYP1A2 4643/4885CYP2C19 4094/4885
US-10454037-B2 Organic semiconductor composition comprising a liquid medium CRY1, NEFM, OR10J3 ACHE 3488/4885CYP1A2 4643/4885CYP2C19 4094/4885
US-10224485-B2 Process for preparing a crystalline organic semiconductor material STOM, SPOP, TTR ACHE 2558/4885CYP1A2 2553/4885CYP2C19 1619/4885

“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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