SCHEMBL14397175

SCHEMBL14397175

C=C(C)/C(C)=C/c1ccc(O)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 5/20 0.54
▸ ESR2 Q92731 5/20 0.54
▸ ALDH1A1 P00352 4/20 0.52
▸ KDM4E B2RXH2 1/20 0.52
▸ NQO2 P16083 3/20 0.48
▸ PTGS1 P23219 3/20 0.48
▸ PTGS2 P35354 3/20 0.48
▸ KMT2A Q03164 3/20 0.43
▸ MEN1 O00255 2/20 0.43
▸ THRB P10828 1/20 0.43
▸ CISD1 Q9NZ45 1/20 0.43
▸ ALDH5A1 P51649 1/20 0.41
▸ ABAT P80404 1/20 0.41
▸ LMNA P02545 1/20 0.39
▸ GAA P10253 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ APP P05067 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ EGFR P00533 1/20 0.39
▸ CYP1A2 P05177 1/20 0.39

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
SCHEMBL22995643 0.80 TRPA1 (0.60) ALDH1A1PTGS1PTGS2CYP1A2HSD17B10
SCHEMBL8051967 0.77 ALDH1A1 (0.63) ESR1ESR2ALDH1A1KDM4ENQO2
SCHEMBL15272115 0.77 ALDH1A1 (0.69) ESR1ESR2ALDH1A1KDM4ENQO2
SCHEMBL8051968 0.77 ALDH1A1 (0.63) ESR1ESR2ALDH1A1KDM4ENQO2
SCHEMBL15272117 0.77 ALDH1A1 (0.69) ESR1ESR2ALDH1A1KDM4ENQO2
SCHEMBL5961638 0.76 ESR1 (0.58) ESR1ESR2ALDH1A1KDM4ENQO2
SCHEMBL5961637 0.76 ESR1 (0.58) ESR1ESR2ALDH1A1KDM4ENQO2
SCHEMBL83883 0.76 AKR1C3 (0.69) ESR1ESR2ALDH1A1KDM4ENQO2
SCHEMBL83882 0.76 AKR1C3 (0.69) ESR1ESR2ALDH1A1KDM4ENQO2
SCHEMBL276966 0.75 ESR1 (0.62) ESR1ESR2ALDH1A1KDM4ENQO2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007112855-A1 SKIN LIGHTENING AGENTS, COMPOSITIONS AND METHODS UNILEVER PLC (NL) 2007-10-11 — — WO disclosed
Send feedback