SCHEMBL6175293

SCHEMBL6175293

CC1(Cc2ccncc2-c2ccccc2)NC(=O)N(c2ccc(S(=O)(=O)C(F)(F)F)cc2)C1=O

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 2/20 0.45
AR P10275 4/20 0.36
NAMPT P43490 1/20 0.34
KMT2A Q03164 2/20 0.34
ALDH1A1 P00352 2/20 0.34
EGLN1 Q9GZT9 2/20 0.33
EGLN3 Q9H6Z9 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
TSHR P16473 1/20 0.32
CYP3A4 P08684 1/20 0.32
GAA P10253 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
TP53 P04637 2/20 0.32
PTGS2 P35354 1/20 0.32
KDM4E B2RXH2 1/20 0.32
LMNA P02545 1/20 0.32

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
SCHEMBL6172334 0.92 IGF1R (0.40) IGF1RARNAMPTKMT2AALDH1A1
SCHEMBL6171779 0.91 IGF1R (0.40) IGF1RARNAMPTKMT2AGAA
SCHEMBL6172113 0.90 IGF1R (0.40) IGF1RARNAMPTKMT2AALDH1A1
SCHEMBL6175003 0.90 CYP3A4 (0.43) IGF1RARALDH1A1CYP3A4GAA
SCHEMBL6169737 0.89 IGF1R (0.43) IGF1RARNAMPTKMT2AALDH1A1
SCHEMBL6171903 0.89 IGF1R (0.45) IGF1RARNAMPTKMT2AALDH1A1
SCHEMBL6173328 0.86 IGF1R (0.44) IGF1RARNAMPTKMT2AALDH1A1
SCHEMBL6175170 0.86 IGF1R (0.44) IGF1RARNAMPTKMT2AALDH1A1
SCHEMBL6175255 0.86 IGF1R (0.44) IGF1RARNAMPTKMT2AALDH1A1
SCHEMBL6171403 0.85 IGF1R (0.43) IGF1RARNAMPTKMT2AALDH1A1

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