SCHEMBL6171783

SCHEMBL6171783

CC(c1ccncc1-c1ccc(Cl)cc1)C1NC(=O)N(c2ccc(S(=O)(=O)C(F)(F)F)cc2)C1=O

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CACNA1B Q00975 2/20 0.35
IGF1R P08069 1/20 0.33
PTGS2 P35354 6/20 0.32
CTSS P25774 1/20 0.32
LMNA P02545 1/20 0.31
PTGS1 P23219 1/20 0.31
TRPV3 Q8NET8 1/20 0.31
PSEN1 P49768 2/20 0.31
PSEN2 P49810 2/20 0.31
APH1B Q8WW43 2/20 0.31
NCSTN Q92542 2/20 0.31
APH1A Q96BI3 2/20 0.31
PSENEN Q9NZ42 2/20 0.31
SLC22A12 Q96S37 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
SCHEMBL6172336 0.92 CACNA1B (0.34) CACNA1BIGF1RPTGS2CTSSLMNA
SCHEMBL6175297 0.91 LMNA (0.39) CACNA1BIGF1RPTGS2LMNATRPV3
SCHEMBL6172120 0.90 KDM4E (0.35) IGF1RPTGS2LMNAPTGS1
SCHEMBL6175007 0.90 SLC22A12 (0.42) CACNA1BIGF1RPTGS2LMNAPTGS1
SCHEMBL6171408 0.87 IGF1R (0.35) IGF1RPTGS2LMNA
SCHEMBL6169741 0.87 IGF1R (0.36) IGF1RPTGS2LMNAPTGS1
SCHEMBL6175175 0.85 IGF1R (0.36) IGF1RPTGS2CTSSLMNA
SCHEMBL6172100 0.85 LMNA (0.38) CACNA1BPTGS2LMNA
SCHEMBL6175512 0.85 IGF1R (0.37) CACNA1BIGF1RLMNASLC22A12
SCHEMBL6173330 0.83 IGF1R (0.40) IGF1RCTSSLMNATRPV3

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