Alcohol

Alcohol

SCHEMBL5350683

CCO.COc1cc(Br)ccc1OC(C)C

nearest known ligand 0.48

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 17)

geneUniProtsupporting neighboursconfidence
MGAM O43451 4/20 0.47
GAA P10253 4/20 0.47
SI P14410 4/20 0.47
MGAM2 Q2M2H8 4/20 0.47
ALDH1A1 P00352 2/20 0.44
MAPT P10636 2/20 0.44
MAPK1 P28482 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.41
KDM4E B2RXH2 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
TSHR P16473 1/20 0.41
GLA P06280 1/20 0.41
LMNA P02545 2/20 0.41
POLB P06746 1/20 0.41
ALOX12 P18054 1/20 0.41
HTT P42858 1/20 0.41
NPSR1 Q6W5P4 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
SCHEMBL7247162 0.91 GAA (0.45) MGAMGAASIMGAM2ALDH1A1
SCHEMBL131870 0.84 ALDH1A1 (0.46) ALDH1A1MAPTSMN1; SMN2KDM4ETDP1
Acetonitrile SCHEMBL5361606 0.83 GAA (0.41) MGAMGAASIMGAM2ALDH1A1
Acetaldehyde SCHEMBL5355547 0.83 GAA (0.43) MGAMGAASIMGAM2ALDH1A1
SCHEMBL580037 0.76 CA2 (0.50) GAAMAPK1SMN1; SMN2KDM4ETSHR
SCHEMBL6408845 0.76 PTGDR2 (0.53) GAAALDH1A1MAPTMAPK1SMN1; SMN2
Methyl Alcohol SCHEMBL28799088 0.76 CA2 (0.52) GAAALDH1A1MAPTSMN1; SMN2KDM4E
SCHEMBL23924764 0.75 KMT2A (0.63) MGAMGAASIMGAM2ALDH1A1
SCHEMBL29419589 0.75 CA2 (0.56) ALDH1A1MAPTMAPK1SMN1; SMN2KDM4E
SCHEMBL20509 0.75 CA2 (0.56) ALDH1A1MAPTMAPK1SMN1; SMN2KDM4E

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-20070027138-A1 Derivatives and analogs of galanthamine SANOCHEMIA PHARMAZEUTIKA AKTIENGESELLSCHAFT 2007-02-01 US disclosed
US-7166588-B2 Derivatives and analogs of galanthamine SANOCHEMIA PHARMAZEUTIKA AKTIENGESELLSCHAFT (AT) 2007-01-23 US disclosed
US-20030199493-A1 Novel derivatives and analogues of galanthamin SANOCHEMIA PHARMAZEUTIKA AKTIENGESELLSCHAFT (AT) 2003-10-23 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 (2 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-20070027138-A1 Derivatives and analogs of galanthamine GALR2, GALR1, GALR3 MGAM 281/4885GAA 269/4885SI 2497/4885
US-20030199493-A1 Novel derivatives and analogues of galanthamin GALR1, GALNT1, GALK1 MGAM 226/4885GAA 166/4885SI 1567/4885

“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.