SCHEMBL6177752

SCHEMBL6177752

CC(c1ccnc(-c2ccc(F)cc2)c1)C1NC(=O)N(c2ccc(S(=O)(=O)C(F)(F)F)cc2)C1=O

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 2/20 0.37
PTGS2 P35354 10/20 0.36
PTGS1 P23219 4/20 0.34
TRPV3 Q8NET8 2/20 0.33
PHGDH O43175 2/20 0.33
TGFBR1 P36897 2/20 0.32
LMNA P02545 1/20 0.32
MAP4K4 O95819 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
SCHEMBL6173805 0.92 IGF1R (0.36) IGF1RPTGS2PTGS1TRPV3LMNA
SCHEMBL6173224 0.91 LMNA (0.36) IGF1RPTGS2PTGS1LMNA
SCHEMBL6177664 0.86 IGF1R (0.37) IGF1RPTGS2PTGS1LMNA
SCHEMBL6173240 0.85 IGF1R (0.37) IGF1RLMNA
SCHEMBL6171105 0.85 LMNA (0.39) LMNA
SCHEMBL6173577 0.84 IGF1R (0.39) IGF1RTRPV3LMNA
SCHEMBL6175008 0.84 IGF1R (0.39) IGF1RTRPV3LMNA
SCHEMBL6170257 0.83 IGF1R (0.39) IGF1RPTGS2PTGS1LMNA
SCHEMBL6174486 0.83 IGF1R (0.38) IGF1RTRPV3LMNA
SCHEMBL6174110 0.82 NPC1 (0.39) 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