SCHEMBL5504436

SCHEMBL5504436

CN=C1COCCN1c1ccc(NC(=O)C2(N)CCN(C)C2)cc1C

nearest known ligand 0.40

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
F10 P00742 15/20 0.40
CNR1 P21554 2/20 0.34
CNR2 P34972 2/20 0.34
L3MBTL1 Q9Y468 1/20 0.33

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
SCHEMBL5509431 0.89 F10 (0.42) F10CNR1CNR2
SCHEMBL5518282 0.89 F10 (0.42) F10CNR1CNR2
SCHEMBL5509687 0.88 F10 (0.51) F10
SCHEMBL5506356 0.87 F10 (0.41) F10CNR1CNR2
SCHEMBL5523153 0.82 F10 (0.52) F10
SCHEMBL5507789 0.81 F10 (0.55) F10
SCHEMBL5509429 0.80 F10 (0.41) F10CNR1CNR2
SCHEMBL5518278 0.80 F10 (0.41) F10CNR1CNR2
SCHEMBL4465653 0.79 F10 (0.43) F10L3MBTL1
SCHEMBL4465652 0.79 F10 (0.43) F10L3MBTL1

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-1747217-A1 NOVEL SUBSTITUTED THIOPHENECARBOXAMIDES, THEIR PRODUCTION AND THEIR USE AS MEDICAMENTS Boehringer Ingelheim International GmbH (DE) 2007-01-31 EP disclosed
WO-2005111029-A1 NOVEL SUBSTITUTED THIOPHENECARBOXAMIDES, THEIR PRODUCTION AND THEIR USE AS MEDICAMENTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2005-11-24 WO disclosed