SCHEMBL6173746

SCHEMBL6173746

CC1(Cc2ccncc2NC(=O)c2ccc(Cl)cc2)NC(=O)N(c2ccc(SC(F)(F)F)cc2)C1=O

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.42
GAA P10253 2/20 0.42
KCNK2 O95069 7/20 0.42
KCNK10 P57789 5/20 0.42
IGF1R P08069 6/20 0.41
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
CYP3A4 P08684 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
ALDH1A1 P00352 1/20 0.35
TRPV1 Q8NER1 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
SCHEMBL6173492 0.92 KCNK2 (0.41) GAAKCNK2KCNK10IGF1RCYP3A4
SCHEMBL6173115 0.91 IGF1R (0.39) KCNK2KCNK10IGF1RMEN1KMT2A
SCHEMBL6174077 0.91 CYP3A4 (0.49) LMNAGAAKCNK2KCNK10IGF1R
SCHEMBL6176971 0.90 IGF1R (0.40) LMNAGAAIGF1RMEN1KMT2A
SCHEMBL6173999 0.88 IGF1R (0.40) GAAKCNK2KCNK10IGF1RMEN1
SCHEMBL6177613 0.84 IGF1R (0.41) IGF1RKMT2ACYP2C9
SCHEMBL6174742 0.83 IGF1R (0.40) GAAIGF1RCYP3A4CYP2C9CYP2C19
SCHEMBL2937565 0.82 IGF1R (0.60) KCNK2KCNK10IGF1R
SCHEMBL6171771 0.82 IGF1R (0.41) IGF1RMEN1KMT2ATRPV1
SCHEMBL6175510 0.82 IGF1R (0.45) IGF1R

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