Alcohol

Alcohol

SCHEMBL28356574

CC1=C(C)C(C)C(C)=C1C.CCO

nearest known ligand 0.38

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 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.38
TSHR P16473 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
SCHEMBL28119678 0.79
SCHEMBL27546281 0.79
SCHEMBL27963954 0.79
SCHEMBL27908624 0.79
SCHEMBL27275899 0.79
Hydrochloric Acid SCHEMBL9233649 0.79
SCHEMBL27739939 0.79
SCHEMBL8103804 0.79
SCHEMBL8098100 0.79
SCHEMBL21356236 0.79

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110759954-A Method for preparing chlorine (pentamethylcyclopentadienyl) (cyclooctadiene) ruthenium (II) 西安凯立新材料股份有限公司 2020-02-07 CN claimed
CN-110759954-A Method for preparing chlorine (pentamethylcyclopentadienyl) (cyclooctadiene) ruthenium (II) 西安凯立新材料股份有限公司 2020-02-07 CN disclosed
CN-110759954-A Method for preparing chlorine (pentamethylcyclopentadienyl) (cyclooctadiene) ruthenium (II) 西安凯立新材料股份有限公司 2020-02-07 CN disclosed