SCHEMBL6172219

SCHEMBL6172219

CC1(Cc2ccnc(NS(=O)(=O)c3ccc(Cl)cc3)c2)NC(=O)N(c2ccc(S(=O)(=O)C(F)(F)F)cc2)C1=O

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.42
THRB P10828 1/20 0.42
CYP2C9 P11712 1/20 0.41
ITGAL P20701 1/20 0.40
IGF1R P08069 3/20 0.40
KMT2A Q03164 2/20 0.37
LMNA P02545 4/20 0.36
KDM4E B2RXH2 2/20 0.36
AR P10275 2/20 0.36
TP53 P04637 1/20 0.35
ALDH1A1 P00352 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
GAA P10253 1/20 0.35
MGAT1 P26572 1/20 0.35
MGAT2 Q10469 1/20 0.35

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
SCHEMBL6173826 0.90 IGF1R (0.53) MAPTTHRBIGF1R
SCHEMBL6222480 0.90 MAPT (0.46) MAPTTHRBCYP2C9ITGALIGF1R
SCHEMBL6173889 0.89 IGF1R (0.50) ITGALIGF1RKMT2AARTP53
SCHEMBL6175526 0.88 IGF1R (0.42) MAPTTHRBITGALIGF1RKMT2A
SCHEMBL6172182 0.88 LMNA (0.44) MAPTTHRBCYP2C9ITGALIGF1R
SCHEMBL6172714 0.86 IGF1R (0.41) MAPTTHRBITGALIGF1RKMT2A
SCHEMBL6173800 0.85 ITGAL (0.42) MAPTTHRBCYP2C9ITGALIGF1R
SCHEMBL6175060 0.84 IGF1R (0.41) ITGALIGF1RKMT2AARMGAT2
SCHEMBL6175130 0.84 GRM5 (0.43) MAPTCYP2C9ITGALIGF1RLMNA
SCHEMBL6174030 0.83 IGF1R (0.39) CYP2C9ITGALIGF1RLMNAKDM4E

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