SCHEMBL19956482

SCHEMBL19956482

CC(C)CSc1nc(C(=O)NC2(CC(N)=O)CSC2)ccc1C1CC1

nearest known ligand 0.78

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 20/20 0.78
▸ CNR1 P21554 2/20 0.45

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
SCHEMBL19956438 0.89 CNR2 (0.78) CNR2CNR1
SCHEMBL15788897 0.88 CNR2 (1.00) CNR2CNR1
SCHEMBL15775143 0.84 CNR2 (0.69) CNR2CNR1
SCHEMBL14226408 0.75 CNR2 (1.00) CNR2CNR1
SCHEMBL15774849 0.75 CNR2 (1.00) CNR2
SCHEMBL14151962 0.74 CNR2 (0.64) CNR2CNR1
SCHEMBL19956426 0.74 CNR2 (0.78) CNR2CNR1
SCHEMBL19956446 0.72 CNR2 (0.81) CNR2CNR1
SCHEMBL20057372 0.70 CNR2 (0.63) CNR2CNR1
SCHEMBL14242991 0.69 CNR2 (0.57) CNR2CNR1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3357918-A1 NOVEL PYRIDINE DERIVATIVES F. Hoffmann-La Roche AG (CH) 2018-08-08 — — EP disclosed
EP-2928881-B1 NOVEL PYRIDINE DERIVATIVES HOFFMANN LA ROCHE (CH) 2018-03-14 — — EP disclosed
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