SCHEMBL6174030

SCHEMBL6174030

CC1(Cc2ccnc(NC(=O)c3ccccc3Cl)c2)NC(=O)N(c2ccc(S(=O)(=O)C(F)(F)F)cc2)C1=O

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 5/20 0.39
CYP2C9 P11712 1/20 0.38
POLB P06746 2/20 0.36
TP53 P04637 1/20 0.36
ALDH1A1 P00352 3/20 0.36
KDM4E B2RXH2 1/20 0.36
HSD17B10 Q99714 1/20 0.36
GAA P10253 1/20 0.35
KIT P10721 1/20 0.35
BRAF P15056 1/20 0.35
ITGAL P20701 1/20 0.35
PDCD1 Q15116 1/20 0.35
CD274 Q9NZQ7 1/20 0.35
LMNA P02545 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34

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
SCHEMBL6172182 0.88 LMNA (0.44) IGF1RCYP2C9ALDH1A1GAAITGAL
SCHEMBL6175130 0.87 GRM5 (0.43) IGF1RCYP2C9POLBTP53ALDH1A1
SCHEMBL6175931 0.87 IGF1R (0.53) IGF1R
SCHEMBL6177003 0.87 TDP1 (0.42) IGF1RKDM4EGAAKITBRAF
SCHEMBL6174108 0.85 NPC1 (0.39) IGF1RCYP2C9TP53ALDH1A1GAA
SCHEMBL6176511 0.85 NAMPT (0.43) IGF1RKITBRAF
SCHEMBL6173886 0.84 IGF1R (0.40) IGF1RCYP2C9ALDH1A1GAA
SCHEMBL6176335 0.83 CYP3A4 (0.46) IGF1RCYP2C9TP53ALDH1A1KDM4E
SCHEMBL2935996 0.83 IGF1R (0.58) IGF1R
SCHEMBL6174213 0.83 IGF1R (0.40) IGF1RCYP2C9ALDH1A1GAALMNA

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