SCHEMBL4373566

SCHEMBL4373566

Cc1c(OC(=O)N[C@@H]2CCCC[C@H]2O)cc(-c2cc(C(F)(F)F)ccc2Cl)n1CC1COCCO1

nearest known ligand 0.58

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 5/20 0.58
CNR2 P34972 3/20 0.42
TRPV1 Q8NER1 1/20 0.38
CRHR1 P34998 10/20 0.35
TSHR P16473 1/20 0.35
CHRM1 P11229 1/20 0.32

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
SCHEMBL4371410 0.92 CNR1 (0.48) CNR1CNR2TRPV1TSHRCHRM1
SCHEMBL4380007 0.92 CNR1 (0.60) CNR1CNR2TRPV1CRHR1TSHR
SCHEMBL4375499 0.91 CNR1 (0.49) CNR1CNR2TRPV1CRHR1TSHR
SCHEMBL4371549 0.87 CNR1 (0.57) CNR1CNR2TRPV1CRHR1
SCHEMBL4380229 0.84 CNR1 (0.49) CNR1CNR2TSHR
SCHEMBL4367945 0.84 CNR1 (0.49) CNR1CNR2TSHR
SCHEMBL4370563 0.84 CNR1 (0.49) CNR1CNR2TSHR
SCHEMBL4368758 0.83 CNR1 (0.51) CNR1CNR2CRHR1TSHR
SCHEMBL4371268 0.82 CNR1 (0.54) CNR1CNR2TRPV1CRHR1TSHR
SCHEMBL4372051 0.82 CNR1 (0.54) CNR1CNR2TRPV1CRHR1TSHR

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