SCHEMBL9537823

SCHEMBL9537823

CCCC/C=C\CC1=CCC[C@@H]1O

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TBXA2R P21731 11/20 0.39
CNR1 P21554 6/20 0.35
CNR2 P34972 6/20 0.35
TRPV1 Q8NER1 6/20 0.35
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
HPGD P15428 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL23270236 0.74 PTGER2 (0.40) ALDH1A1
SCHEMBL9133779 0.62 FAAH (0.55) TBXA2RTRPV1MEN1ALDH1A1MAPT
SCHEMBL9133782 0.62 FAAH (0.55) TBXA2RTRPV1MEN1ALDH1A1MAPT
SCHEMBL93116 0.62 FAAH (0.55) TBXA2RTRPV1MEN1ALDH1A1MAPT
SCHEMBL23566850 0.62 FAAH (0.55) TBXA2RTRPV1MEN1ALDH1A1MAPT
SCHEMBL93117 0.62 FAAH (0.55) TBXA2RTRPV1MEN1ALDH1A1MAPT
SCHEMBL17262056 0.62 FAAH (0.55) TBXA2RTRPV1MEN1ALDH1A1MAPT
SCHEMBL9203376 0.61
SCHEMBL9203372 0.61
Bromide SCHEMBL29979905 0.60 FAAH (0.52) TBXA2RTRPV1MEN1ALDH1A1MAPT

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
EP-0541593-A1 CYCLOPENTANE DERIVATIVES, PROCESS FOR PRODUCING THEM AND THEIR PHARMACEUTICAL USE. SCHERING AG (DE) 1993-05-19 EP disclosed