SCHEMBL6169828

SCHEMBL6169828

CNC(c1cc[n+](C2CCCCC2)cc1)C1(C)NC(=O)N(c2ccc(SC(F)(F)F)cc2)C1=O

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 14/20 0.38
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
POLB P06746 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
SCHEMBL2940215 0.80 IGF1R (0.45) IGF1R
SCHEMBL2936442 0.76 IGF1R (0.35) IGF1R
SCHEMBL2936722 0.76 IGF1R (0.35) IGF1R
SCHEMBL1877659 0.68 AR (0.55) IGF1RNPC1RAB9A
SCHEMBL6173034 0.66 IGF1R (0.38) IGF1R
SCHEMBL31330450 0.66 NPC1 (0.66) IGF1RNPC1RAB9APOLB
SCHEMBL31572984 0.65 NPC1 (0.57) IGF1RNPC1RAB9APOLB
SCHEMBL6174396 0.64 IGF1R (0.58) IGF1RNPC1RAB9A
SCHEMBL6170998 0.64 IGF1R (0.43) IGF1RNPC1RAB9A
SCHEMBL31330463 0.64 IGF1R (0.47) IGF1RNPC1RAB9A

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-1599464-A2 NOVEL CYCLIC UREA DERIVATIVES, PREPARATION METHOD THEREOF AND PHARMACEUTICAL USE OF SAME AS KINASE INHIBITORS Aventis Pharma S.A. (FR) 2005-11-30 EP disclosed
WO-2004070050-A2 CYCLIC UREA DERIVATIVES, PREPARATION METHOD THEREOF AND PHARMACEUTICAL USE OF SAME AS KINASE INHIBITORS AVENTIS PHARMA S.A. (FR) 2004-08-19 WO disclosed