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SCHEMBL6172850

SCHEMBL6172850

CC(c1ccncc1NS(=O)(=O)N1CCOCC1)C1(C(C)c2ccncc2NS(=O)(=O)N2CCOCC2)NC(=O)N(c2ccc(SC(F)(F)F)cc2)C1=O

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ IGF1R P08069 4/20 0.35
▸ CYP11B2 P19099 1/20 0.33
▸ CYP2C9 P11712 1/20 0.31
▸ CYP2C19 P33261 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
SCHEMBL6173377 0.88 LIPE (0.34) CYP11B2CYP2C9CYP2C19
SCHEMBL6173900 0.86 IGF1R (0.42) IGF1R
SCHEMBL6174952 0.85 IGF1R (0.38) IGF1RCYP2C9CYP2C19
SCHEMBL6174729 0.82 IGF1R (0.37) IGF1R
SCHEMBL6172545 0.81 CYP11B2 (0.33) IGF1RCYP11B2CYP2C9CYP2C19
SCHEMBL6172542 0.81 IGF1R (0.38) IGF1RCYP11B2
SCHEMBL6175279 0.80 FKBP1A (0.37) IGF1RCYP2C9CYP2C19
SCHEMBL6172761 0.79 IGF1R (0.42) IGF1R
SCHEMBL6172115 0.79 IGF1R (0.37) IGF1RCYP2C9CYP2C19
SCHEMBL6174921 0.78 IGF1R (0.43) IGF1RCYP2C9CYP2C19

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