SCHEMBL4376908

SCHEMBL4376908

Cc1c(OC(=O)NCC(O)(c2ccccc2)C(F)(F)F)cc(-c2cc(C(F)(F)F)ccc2C(F)(F)F)n1C[C@H]1CCCO1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 14/20 0.39
TSHR P16473 1/20 0.39
ALDH1A1 P00352 3/20 0.39
KDM4E B2RXH2 2/20 0.39
GAA P10253 2/20 0.39
GLA P06280 1/20 0.39
HPGD P15428 1/20 0.39
MAPK1 P28482 1/20 0.38
KMT2A Q03164 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
LDHA P00338 1/20 0.36
GRIN1 Q05586 1/20 0.36
GRIN2B Q13224 1/20 0.36
HTT P42858 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL4382397 0.91 CNR2 (0.42) CNR2TSHRALDH1A1KDM4EGAA
SCHEMBL4371354 0.91 CNR2 (0.44) CNR2TSHRALDH1A1KDM4EGAA
SCHEMBL4374299 0.89 CNR2 (0.42) CNR2TSHRALDH1A1KDM4EGAA
SCHEMBL4369418 0.87 TSHR (0.38) CNR2TSHRALDH1A1KDM4EGAA
SCHEMBL4380548 0.87 TSHR (0.38) CNR2TSHRALDH1A1KDM4EGAA
SCHEMBL4372092 0.85 ALDH1A1 (0.39) CNR2TSHRALDH1A1KDM4EGAA
SCHEMBL4375460 0.84 TSHR (0.40) CNR2TSHRALDH1A1KDM4EGAA
SCHEMBL4371026 0.84 RAF1 (0.35) CNR2GAAKMT2A
SCHEMBL4376045 0.84 TSHR (0.42) CNR2TSHRALDH1A1KDM4EGAA
SCHEMBL4374742 0.84 TSHR (0.42) CNR2TSHRALDH1A1KDM4EGAA

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-1749002-B1 PYRROLE OR IMIDAZOLE AMIDES FOR TREATING OBESITY HOFFMANN LA ROCHE (CH) 2009-05-27 EP claimed