SCHEMBL5504077

SCHEMBL5504077

Cc1cc(NC(=O)C(C)(C)NC(=O)Oc2ccc(Br)s2)ccc1N1CCCCNC1=O

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
F10 P00742 7/20 0.42
AR P10275 2/20 0.36
NPY2R P49146 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
MAPT P10636 2/20 0.32
TP53 P04637 1/20 0.32
GFER P55789 1/20 0.31
WDR5 P61964 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
SCHEMBL4467671 0.86 F10 (0.56) F10ARNPC1RAB9AMAPT
SCHEMBL5504066 0.85 F10 (0.46) F10ARNPY2RNPC1RAB9A
SCHEMBL5505635 0.84 F10 (0.45) F10ARNPY2RMAPTTP53
SCHEMBL4473630 0.84 F10 (0.57) F10ARNPC1RAB9AMAPT
SCHEMBL5505524 0.82 F10 (0.40) F10ARNPY2RMAPTTP53
SCHEMBL5507256 0.81 F10 (0.39) F10ARNPY2RMAPTTP53
SCHEMBL5503712 0.80 F10 (0.38) F10ARNPY2RNPC1RAB9A
SCHEMBL5510944 0.79 F10 (0.38) F10ARNPY2RWDR5
SCHEMBL5517405 0.76 F10 (0.40) F10ARNPY2RNPC1RAB9A
SCHEMBL5505095 0.76 F10 (0.45) F10ARNPY2R

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