SCHEMBL6172079

SCHEMBL6172079

CNc1cc(CC2(C)NC(=O)N(c3ccc(OC(F)(F)F)cc3)C2=O)ccn1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 10/20 0.47
ITGAL P20701 1/20 0.39
AR P10275 3/20 0.38
BRD4 O60885 1/20 0.37
POLB P06746 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
TSHR P16473 1/20 0.36
KMT2A Q03164 1/20 0.36
GPR39 O43194 1/20 0.36
CYP3A4 P08684 1/20 0.35
GAA P10253 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 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
SCHEMBL6175976 0.89 IGF1R (0.41) IGF1RITGALARPOLBL3MBTL1
SCHEMBL6169398 0.89 IGF1R (0.49) IGF1RITGALARPOLBL3MBTL1
SCHEMBL6173180 0.87 IGF1R (0.40) IGF1RITGALARPOLBL3MBTL1
SCHEMBL6175657 0.86 IGF1R (0.45) IGF1RITGALARPOLBL3MBTL1
SCHEMBL6173435 0.86 IGF1R (0.45) IGF1RITGALARPOLBL3MBTL1
SCHEMBL6176754 0.86 ITGAL (0.44) IGF1RITGALARPOLBL3MBTL1
SCHEMBL6172735 0.86 IGF1R (0.42) IGF1RARPOLBL3MBTL1CYP3A4
SCHEMBL6172261 0.85 IGF1R (0.49) IGF1RITGALARCYP3A4GAA
SCHEMBL6176131 0.85 SMN1; SMN2 (0.39) IGF1RARTSHRKMT2A
SCHEMBL6173624 0.85 IGF1R (0.42) IGF1RITGALARCYP3A4GAA

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