SCHEMBL19205044

SCHEMBL19205044

Cc1ccc(-c2ccccc2)c(C(=O)N2CCCC2(C)c2nc3cc(C(F)(F)F)ccc3[nH]2)c1

nearest known ligand 0.79

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HCRTR1 O43613 20/20 0.79
HCRTR2 O43614 19/20 0.79

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
SCHEMBL16779342 0.95 HCRTR1 (0.87) HCRTR1HCRTR2
SCHEMBL18274343 0.95 HCRTR1 (0.87) HCRTR1HCRTR2
SCHEMBL16779339 0.95 HCRTR1 (0.87) HCRTR1HCRTR2
SCHEMBL16779627 0.95 HCRTR1 (0.87) HCRTR1HCRTR2
SCHEMBL18274223 0.94 HCRTR1 (0.88) HCRTR1HCRTR2
SCHEMBL16779596 0.94 HCRTR1 (0.88) HCRTR1HCRTR2
SCHEMBL16779737 0.94 HCRTR1 (0.88) HCRTR1HCRTR2
SCHEMBL16779733 0.94 HCRTR1 (0.88) HCRTR1HCRTR2
SCHEMBL16779758 0.93 HCRTR1 (0.88) HCRTR1HCRTR2
SCHEMBL16779567 0.93 HCRTR1 (0.88) HCRTR1HCRTR2

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
US-9732075-B2 Benzimidazole-proline derivatives IDORSIA PHARMACEUTICALS LTD (CH) 2017-08-15 US disclosed