SCHEMBL11481925

SCHEMBL11481925

CCC(=O)C=Cc1ccc2c(c1)OCO2

nearest known ligand 0.68

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ TRPM8 Q7Z2W7 4/20 0.68
▸ ALDH1A1 P00352 5/20 0.65
▸ KDM4E B2RXH2 4/20 0.65
▸ MAPT P10636 2/20 0.63
▸ APP P05067 1/20 0.63
▸ MEN1 O00255 2/20 0.61
▸ KMT2A Q03164 2/20 0.61
▸ HPGD P15428 3/20 0.60
▸ CYP1A2 P05177 1/20 0.58
▸ HSD17B10 Q99714 1/20 0.58
▸ MAOB P27338 1/20 0.58
▸ GABRA1 P14867 1/20 0.57
▸ GABRG2 P18507 1/20 0.57
▸ GABRB3 P28472 1/20 0.57
▸ GABRA3 P34903 1/20 0.57
▸ GABRA2 P47869 1/20 0.57
▸ GABRB2 P47870 1/20 0.57

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
SCHEMBL11481924 1.00 TRPM8 (0.68) TRPM8ALDH1A1KDM4EMAPTAPP
Hydrochloric Acid SCHEMBL27699758 0.98 TRPM8 (0.67) TRPM8ALDH1A1KDM4EMAPTAPP
SCHEMBL17691541 0.89 MAPT (0.71) TRPM8ALDH1A1KDM4EMAPTAPP
SCHEMBL16576815 0.88 TRPM8 (0.68) TRPM8ALDH1A1KDM4EMAPTAPP
SCHEMBL27675421 0.84 TRPM8 (0.56) TRPM8ALDH1A1KDM4EMAPTAPP
SCHEMBL11766659 0.84 ALDH1A1 (0.60) TRPM8ALDH1A1KDM4EMAPTAPP
SCHEMBL11766665 0.84 ALDH1A1 (0.60) TRPM8ALDH1A1KDM4EMAPTAPP
SCHEMBL24419889 0.84 TRPM8 (0.50) TRPM8ALDH1A1KDM4EMAPTAPP
SCHEMBL9548237 0.84 MAPT (0.60) TRPM8ALDH1A1KDM4EMAPTAPP
SCHEMBL9548241 0.84 MAPT (0.60) TRPM8ALDH1A1KDM4EMAPTAPP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4209517-A α-Ethylenic alcohols and ketones, their preparation, and their use as medicaments UNICLER (FR) 1980-06-24 — — US disclosed
US-4012232-A Stabilized photochromic materials Chu, Nori Y. C. (US) 1977-03-15 — — US disclosed
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