Alcohol

Alcohol

SCHEMBL4274896

CC(C)(C)OC(=O)N1CCC[C@H](O)C1.CCO

nearest known ligand 0.54

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 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.54
ALDH1A1 P00352 1/20 0.54
MAPT P10636 1/20 0.54
KMT2A Q03164 1/20 0.54
HPGD P15428 1/20 0.49
NR1H2 P55055 1/20 0.47
EPHX1 P07099 1/20 0.43
CHRM2 P08172 1/20 0.43
CHRM1 P11229 1/20 0.43
CHRM3 P20309 1/20 0.43
PREP P48147 1/20 0.42
GLS O94925 1/20 0.42
USP2 O75604 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
USP30 Q70CQ3 2/20 0.41
RECQL P46063 1/20 0.40
ACKR3 P25106 1/20 0.40
CTSD P07339 1/20 0.40
BACE1 P56817 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
SCHEMBL30862413 0.94 MEN1 (0.56) MEN1ALDH1A1MAPTKMT2AHPGD
SCHEMBL1068107 0.94 MEN1 (0.56) MEN1ALDH1A1MAPTKMT2AHPGD
SCHEMBL215146 0.94 MEN1 (0.56) MEN1ALDH1A1MAPTKMT2AHPGD
SCHEMBL190483 0.94 MEN1 (0.56) MEN1ALDH1A1MAPTKMT2AHPGD
Water SCHEMBL28231930 0.92 MEN1 (0.58) MEN1ALDH1A1MAPTKMT2AHPGD
Water SCHEMBL28231929 0.92 MEN1 (0.58) MEN1ALDH1A1MAPTKMT2AHPGD
Ammonia Solution, Strong SCHEMBL28243999 0.92 MEN1 (0.55) MEN1ALDH1A1MAPTKMT2AHPGD
SCHEMBL24438917 0.89 HPGD (0.56) MEN1ALDH1A1MAPTKMT2AHPGD
SCHEMBL22439376 0.89 HPGD (0.56) MEN1ALDH1A1MAPTKMT2AHPGD
SCHEMBL2820898 0.89 HPGD (0.56) MEN1ALDH1A1MAPTKMT2AHPGD

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
US-20090176307-A1 Compounds, Compositions and Methods CYTOKINETICS, INC. 2009-07-09 US disclosed
US-7491826-B2 Compounds, compositions and methods CYTOKINETICS, INC. (US) 2009-02-17 US disclosed
US-20050159416-A1 Compounds, compositions and methods CYTOKINETICS, INCORPORATED 2005-07-21 US 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-20050159416-A1 Compounds, compositions and methods TNNI3, TNNC1, TNNT2 MEN1 4344/4885ALDH1A1 4381/4885MAPT 663/4885

“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.