SCHEMBL17383192

SCHEMBL17383192

CCS(=O)(=O)c1ccc(-n2cncn2)nc1-c1nc2cc(SC(F)(F)F)ccc2n1C

nearest known ligand 0.30

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 1/20 0.30
▸ NPC1 O15118 1/20 0.30
▸ RAB9A P51151 1/20 0.30
▸ ALOX5AP P20292 1/20 0.30

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
SCHEMBL17383123 0.87 DDR1 (0.36) CNR2
SCHEMBL17383249 0.85 LMNA (0.45) CNR2NPC1RAB9AALOX5AP
SCHEMBL17383194 0.85 DDR1 (0.32) NPC1RAB9A
SCHEMBL29543391 0.84 LMNA (0.35) CNR2NPC1RAB9A
SCHEMBL27145437 0.84 LMNA (0.35) CNR2NPC1RAB9A
SCHEMBL17382576 0.83 CA12 (0.32) CNR2NPC1RAB9AALOX5AP
SCHEMBL17383242 0.82 CNR2 (0.34) CNR2NPC1RAB9A
SCHEMBL17949562 0.82 SMN1; SMN2 (0.32) CNR2NPC1RAB9AALOX5AP
SCHEMBL29542880 0.82 CNR2 (0.35) CNR2NPC1RAB9A
SCHEMBL17383232 0.82 CNR2 (0.34) CNR2NPC1RAB9A

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-2015198859-A1 CONDENSED HETEROCYCLIC COMPOUND 住友化学株式会社 2015-12-30 — — WO disclosed
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