SCHEMBL2940771

SCHEMBL2940771

CC1C(=O)N(c2ccc(SC(F)(F)F)cc2)C(=O)N1Cc1ccncc1

nearest known ligand 0.60

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 13/20 0.60
SMO Q99835 4/20 0.52
HCRTR1 O43613 1/20 0.44
HCRTR2 O43614 1/20 0.44

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
SCHEMBL2940768 1.00 IGF1R (0.60) IGF1RSMOHCRTR1HCRTR2
SCHEMBL2941262 1.00 IGF1R (0.60) IGF1RSMOHCRTR1HCRTR2
Trifluoroacetic Acid SCHEMBL3726606 0.94 IGF1R (0.54) IGF1RSMOHCRTR1HCRTR2
Trifluoroacetic Acid SCHEMBL3734827 0.94 IGF1R (0.54) IGF1RSMOHCRTR1HCRTR2
SCHEMBL2936597 0.89 IGF1R (0.58) IGF1RSMOHCRTR1HCRTR2
SCHEMBL2936591 0.89 IGF1R (0.58) IGF1RSMOHCRTR1HCRTR2
SCHEMBL2938196 0.87 IGF1R (0.64) IGF1RSMO
SCHEMBL2934297 0.86 IGF1R (0.63) IGF1RSMO
SCHEMBL2937620 0.86 IGF1R (0.51) IGF1RSMO
SCHEMBL2939403 0.85 IGF1R (0.50) IGF1RSMO

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-1599464-B1 NOVEL CYCLIC UREA DERIVATIVES, PREPARATION METHOD THEREOF AND PHARMACEUTICAL USE OF SAME AS KINASE INHIBITORS AVENTIS PHARMA SA (FR) 2010-09-22 EP disclosed