SCHEMBL1509045

SCHEMBL1509045

Cc1cc(Cl)c(F)cc1[C@@H]1NS(=O)(=O)N[C@]1(C)c1ccc(Cl)nc1

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KCNQ3 O43525 1/20 0.31
KCNQ2 O43526 1/20 0.31
KCNE1 P15382 1/20 0.31
KCNQ1 P51787 1/20 0.31

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
SCHEMBL1509102 0.84 TAAR1 (0.30)
SCHEMBL1508741 0.83 MDM2 (0.36) KCNQ3KCNQ2KCNE1KCNQ1
SCHEMBL7921145 0.83 MDM2 (0.36) KCNQ3KCNQ2KCNE1KCNQ1
SCHEMBL1508874 0.75 KCNQ3 (0.39) KCNQ3KCNQ2KCNE1KCNQ1
SCHEMBL14793575 0.75 KMT2A (0.33) KCNQ3KCNQ2KCNE1KCNQ1
SCHEMBL14817142 0.75 KMT2A (0.33) KCNQ3KCNQ2KCNE1KCNQ1
SCHEMBL1508733 0.73 KMO (0.32)
SCHEMBL1508742 0.73 KCNQ3 (0.34) KCNQ3KCNQ2KCNE1KCNQ1
SCHEMBL1508739 0.73 KCNQ3 (0.34) KCNQ3KCNQ2KCNE1KCNQ1
SCHEMBL1509104 0.73 TAAR1 (0.30)

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
EP-2298778-A1 IMIDAZOTHIAZOLE DERIVATIVE HAVING 4,7-DIAZASPIROÝ2.5¨OCTANE RING STRUCTURE Daiichi Sankyo Company, Limited (JP) 2011-03-23 EP disclosed