SCHEMBL6174916

SCHEMBL6174916

CC(c1ccnc2cc(N3CCCCC3)ccc12)C1NC(=O)N(c2ccc(SC(F)(F)F)cc2)C1=O

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 12/20 0.35
PDE2A O00408 4/20 0.35
SMN1; SMN2 Q16637 1/20 0.34
IP6K1 Q92551 1/20 0.32
AR P10275 1/20 0.32
CHKA P35790 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
SCHEMBL6173610 0.87 IGF1R (0.37) IGF1RSMN1; SMN2
SCHEMBL6174287 0.87 IGF1R (0.38) IGF1RSMN1; SMN2
SCHEMBL6175589 0.85 IGF1R (0.38) IGF1RPDE2ASMN1; SMN2
SCHEMBL6173494 0.84 IGF1R (0.33) IGF1RPDE2A
SCHEMBL6174393 0.82 SMN1; SMN2 (0.43) IGF1RSMN1; SMN2
SCHEMBL6176997 0.82 KDM4E (0.42) PDE2ASMN1; SMN2AR
SCHEMBL6173968 0.81 IGF1R (0.35) IGF1RPDE2A
SCHEMBL6173598 0.80 IGF1R (0.39) IGF1RPDE2A
SCHEMBL6174902 0.80 SMN1; SMN2 (0.39) IGF1RSMN1; SMN2
SCHEMBL6172293 0.80 IGF1R (0.40) IGF1RSMN1; SMN2

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