SCHEMBL12720165

SCHEMBL12720165

COCCc1coc(C2CC(c3ccc(C(F)(F)F)cc3)CN(C(=O)N3CC(O)C3)C2)n1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
F2R P25116 10/20 0.42
FASN P49327 2/20 0.39
CNR1 P21554 1/20 0.39
TMEM97 Q5BJF2 1/20 0.39
HSD11B1 P28845 1/20 0.35
P2RY14 Q15391 1/20 0.34
PPARG P37231 1/20 0.33
PPARA Q07869 1/20 0.33
TRPV1 Q8NER1 1/20 0.33
LIPE Q05469 1/20 0.33
PROKR1 Q8TCW9 2/20 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
SCHEMBL12720304 0.91 F2R (0.39) F2RFASNCNR1TMEM97HSD11B1
SCHEMBL13808094 0.88 F2R (0.52) F2RFASNCNR1TMEM97P2RY14
SCHEMBL13808106 0.88 F2R (0.44) F2RFASNCNR1TMEM97LIPE
SCHEMBL12720052 0.85 F2R (0.49) F2RFASNCNR1TMEM97
SCHEMBL10234373 0.84 F2R (0.46) F2RFASNCNR1TMEM97HSD11B1
SCHEMBL13808280 0.83 F2R (0.48) F2RFASNCNR1TMEM97HSD11B1
SCHEMBL12720065 0.83 F2R (0.47) F2RCNR1TMEM97HSD11B1LIPE
SCHEMBL13808129 0.83 F2R (0.41) F2RCNR1TMEM97PROKR1
SCHEMBL12720610 0.81 F2R (0.39) F2RFASNCNR1TMEM97LIPE
SCHEMBL13050750 0.81 F2R (0.47) F2RCNR1TMEM97HSD11B1LIPE

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-2227466-B1 HETEROARYL-SUBSTITUTED PIPERIDINES BAYER SCHERING PHARMA AG (DE) 2011-04-20 EP disclosed