SCHEMBL19965244

SCHEMBL19965244

Ic1nccc(N2Cc3ccccc3S2)n1

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ROCK1 Q13464 2/20 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
SCHEMBL27992493 0.74 ALDH1A1 (0.36)
SCHEMBL19965020 0.74 CDK4 (0.36)
SCHEMBL19965170 0.68 KDM4E (0.39)
SCHEMBL19155132 0.67 NPC1 (0.38)
SCHEMBL29406937 0.67 NPC1 (0.38)
SCHEMBL19965080 0.65 LMNA (0.38)
SCHEMBL19965171 0.63 BRAF (0.36)
SCHEMBL19965160 0.63 CYP1A2 (0.41)
SCHEMBL19674181 0.62 RYR2 (0.40)
SCHEMBL3894929 0.62 RYR2 (0.36)

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
WO-2018049324-A1 MONOCYCLIC COMPOUNDS USEFUL AS GPR120 MODULATORS NUMERATE, INC. (US) 2018-03-15 WO disclosed