SCHEMBL6172968

SCHEMBL6172968

CN(C(=O)c1cc(CC2(C)NC(=O)N(c3ccc(S(=O)(=O)C(F)(F)F)cc3)C2=O)ccn1)c1ccc(Cl)cc1

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ITGAL P20701 1/20 0.37
CYP2C9 P11712 1/20 0.36
IGF1R P08069 5/20 0.36
AR P10275 4/20 0.35
THRB P10828 1/20 0.34
MAPT P10636 1/20 0.34
LMNA P02545 2/20 0.34
GAA P10253 1/20 0.34
PSEN1 P49768 1/20 0.32
PSEN2 P49810 1/20 0.32
APH1B Q8WW43 1/20 0.32
NCSTN Q92542 1/20 0.32
APH1A Q96BI3 1/20 0.32
PSENEN Q9NZ42 1/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 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
SCHEMBL6173981 0.89 IGF1R (0.40) ITGALCYP2C9IGF1RARGAA
SCHEMBL6175141 0.84 IGF1R (0.47) ITGALCYP2C9IGF1RARGAA
SCHEMBL2936726 0.83 IGF1R (0.53) IGF1R
SCHEMBL6173595 0.82 IGF1R (0.49) ITGALCYP2C9IGF1RARGAA
SCHEMBL6173800 0.82 ITGAL (0.42) ITGALCYP2C9IGF1RARTHRB
SCHEMBL6172182 0.81 LMNA (0.44) ITGALCYP2C9IGF1RARTHRB
SCHEMBL6174831 0.80 IGF1R (0.41) ITGALCYP2C9IGF1RTHRBKMT2A
SCHEMBL6172219 0.80 MAPT (0.42) ITGALCYP2C9IGF1RARTHRB
SCHEMBL2942075 0.79 PPARD (0.37) IGF1RPSEN1PSEN2APH1BNCSTN
SCHEMBL2939241 0.79 IGF1R (0.52) IGF1RMAPTPSEN1PSEN2APH1B

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