SCHEMBL4368598

SCHEMBL4368598

Cc1c(OC(=O)NC2CCCCC2)cc(-c2cc(C(F)(F)F)ccc2F)n1C[C@H]1CCCO1

nearest known ligand 0.42

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 16/20 0.42
TSHR P16473 1/20 0.42
CNR1 P21554 1/20 0.41

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
SCHEMBL4374742 0.92 TSHR (0.42) CNR2TSHRCNR1
SCHEMBL4368758 0.91 CNR1 (0.51) CNR2TSHRCNR1
SCHEMBL4367945 0.90 CNR1 (0.49) CNR2TSHRCNR1
SCHEMBL4370563 0.90 CNR1 (0.49) CNR2TSHRCNR1
SCHEMBL4372987 0.88 CNR1 (0.39) CNR2TSHRCNR1
SCHEMBL4423581 0.86 CNR1 (0.46) CNR1
SCHEMBL4371543 0.86 CNR1 (0.53) CNR2TSHRCNR1
SCHEMBL4373433 0.86 ALDH1A1 (0.40) CNR2TSHR
SCHEMBL4375089 0.85 CNR1 (0.39) CNR1
SCHEMBL4376045 0.84 TSHR (0.42) CNR2TSHRCNR1

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