SCHEMBL2999392

SCHEMBL2999392

Cc1cnccc1CN1C(=O)N(c2ccc(S(=O)(=O)C(F)(F)F)cc2)C(=O)[C@@H]1C

nearest known ligand 0.67

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 2/20 0.67
SMO Q99835 4/20 0.39
CTSS P25774 1/20 0.34
TAS2R8 Q9NYW2 3/20 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
SCHEMBL2936802 1.00 IGF1R (0.67) IGF1RSMOCTSSTAS2R8
SCHEMBL2936799 1.00 IGF1R (0.67) IGF1RSMOCTSSTAS2R8
Trifluoroacetic Acid SCHEMBL3736464 0.94 IGF1R (0.61) IGF1RSMOCTSSTAS2R8
Trifluoroacetic Acid SCHEMBL3732089 0.94 IGF1R (0.61) IGF1RSMOCTSSTAS2R8
Trifluoroacetic Acid SCHEMBL2937627 0.94 IGF1R (0.61) IGF1RSMOCTSSTAS2R8
SCHEMBL2938454 0.90 IGF1R (0.55) IGF1RCTSS
SCHEMBL2938450 0.90 IGF1R (0.55) IGF1RCTSS
SCHEMBL2936828 0.90 IGF1R (0.58) IGF1RSMOCTSS
SCHEMBL2939398 0.90 IGF1R (0.67) IGF1RSMOCTSSTAS2R8
SCHEMBL2932195 0.90 IGF1R (0.67) IGF1RSMOCTSSTAS2R8

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