Alcohol

Alcohol

SCHEMBL7142853

CCO.NC=CCc1cc2ccccc2[nH]1

nearest known ligand 0.51

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

MMP1MMP13MMP7MMP8polrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

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

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 1/20 0.51
MTNR1A P48039 1/20 0.43
MTNR1B P49286 1/20 0.43
HRH4 Q9H3N8 1/20 0.41
KDM4E B2RXH2 2/20 0.40
ALDH1A1 P00352 2/20 0.40
AOC3 Q16853 2/20 0.40
MAPT P10636 1/20 0.40
IDO1 P14902 2/20 0.39
HRH3 Q9Y5N1 1/20 0.39
AHR P35869 1/20 0.39
OPRK1 P41145 1/20 0.39
GAA P10253 1/20 0.39
MAPK1 P28482 1/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38

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
SCHEMBL4333117 0.92 LOXL2 (0.59) LOXL2MTNR1AMTNR1BHRH4KDM4E
SCHEMBL7549813 0.82 LOXL2 (0.59) LOXL2MTNR1AMTNR1BHRH4AOC3
SCHEMBL7355775 0.79 LOXL2 (0.59) LOXL2MTNR1AMTNR1BHRH4KDM4E
SCHEMBL2185508 0.79 LOXL2 (0.55) LOXL2MTNR1AMTNR1BHRH4AOC3
SCHEMBL653529 0.79 LOXL2 (0.63) LOXL2MTNR1AMTNR1BHRH4KDM4E
SCHEMBL5642064 0.77 LOXL2 (0.60) LOXL2MTNR1AMTNR1BHRH4AOC3
SCHEMBL6156791 0.76 LOXL2 (0.55) LOXL2MTNR1AMTNR1BHRH4AOC3
SCHEMBL5586763 0.76 LOXL2 (0.55) LOXL2MTNR1AMTNR1BHRH4AOC3
SCHEMBL1327113 0.75 LOXL2 (0.58) LOXL2MTNR1AMTNR1BHRH4KDM4E
SCHEMBL7551798 0.74 MTNR1A (0.55) LOXL2MTNR1AMTNR1BHRH4KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6620824-B2 Process for the synthesis of gonadotropin releasing hormone antagonists MERCK & CO., INC. 2003-09-16 US disclosed
EP-1095038-B1 ANTAGONISTS OF GONADOTROPIN RELEASING HORMONE MERCK & CO INC (US) 2003-09-03 EP disclosed
US-20030013876-A1 Process for the synthesis of gonadotropin releasing hormone antagonists MERCK & CO., INC. 2003-01-16 US disclosed
EP-1067930-A4 ANTAGONISTS OF GONADOTROPIN RELEASING HORMONE MERCK & CO INC (US) 2002-09-18 EP disclosed
EP-1171135-A4 6-AZAINDOLE COMPOUNDS AS ANTAGONISTS OF GONADOTROPIN RELEASING HORMONE MERCK & CO INC (US) 2002-05-15 EP disclosed
EP-1161431-A4 6-AZAINDOLE COMPOUNDS AS ANTAGONISTS OF GONADOTROPIN RELEASING HORMONE MERCK & CO INC (US) 2002-04-24 EP disclosed
EP-1165075-A4 6-AZAINDOLE COMPOUNDS AS ANTAGONISTS OF GONADOTROPIN RELEASING HORMONE MERCK & CO INC (US) 2002-04-10 EP disclosed
EP-1049472-A4 ANTAGONISTS OF GONADOTROPIN RELEASING HORMONE MERCK & CO INC (US) 2002-04-03 EP disclosed
EP-1027046-A4 ANTAGONISTS OF GONADOTROPIN RELEASING HORMONE MERCK & CO INC (US) 2002-04-03 EP disclosed
EP-0873336-B1 ANTAGONISTS OF GONADOTROPIN RELEASING HORMONE MERCK & CO INC (US) 2002-03-27 EP disclosed
EP-0882040-A1 ANTAGONISTS OF GONADOTROPIN RELEASING HORMONE Merck & Co., Inc. (US) 1998-12-09 EP disclosed
EP-0873336-A1 ANTAGONISTS OF GONADOTROPIN RELEASING HORMONE Merck & Co., Inc. (a New Jersey corp.) (US) 1998-10-28 EP disclosed
EP-0871624-A1 ANTAGONISTS OF GONADOTROPIN RELEASING HORMONE Merck & Co., Inc. (US) 1998-10-21 EP disclosed
EP-0868178-A1 ANTAGONISTS OF GONADOTROPIN RELEASING HORMONE Merck & Co., Inc. (US) 1998-10-07 EP disclosed
US-5780437-A ADMINISTERING TO TREAT SEX-HORMONE RELATED DISORDERS MERCK & CO., INC. (US) 1998-07-14 US disclosed
US-5756507-A TREATING SEX HORMONE RELATED DISORDERS MERCK & CO., INC. (US) 1998-05-26 US disclosed
WO-1997021707-A1 ANTAGONISTS OF GONADOTROPIN RELEASING HORMONE MERCK & CO., INC. (US) 1997-06-19 WO disclosed
WO-1997021704-A1 ANTAGONISTS OF GONADOTROPIN RELEASING HORMONE MERCK & CO., INC. (US) 1997-06-19 WO disclosed
WO-1997021435-A1 ANTAGONISTS OF GONADOTROPIN RELEASING HORMONE MERCK & CO., INC. (US) 1997-06-19 WO disclosed
WO-1997021703-A1 ANTAGONISTS OF GONADOTROPIN RELEASING HORMONE MERCK & CO., INC. (US) 1997-06-19 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-20030013876-A1 Process for the synthesis of gonadotropin releasing hormone antagonists GNRHR, FSHR, GHRHR LOXL2 4595/4885MTNR1A 185/4885MTNR1B 70/4885

“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.