SCHEMBL6174213

SCHEMBL6174213

CC1(Cc2ccnc(NNC(=O)c3ccccc3)c2)NC(=O)N(c2ccc(S(=O)(=O)C(F)(F)F)cc2)C1=O

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 9/20 0.40
CYP3A4 P08684 2/20 0.35
GAA P10253 2/20 0.35
CYP2C9 P11712 2/20 0.35
CYP2C19 P33261 2/20 0.35
ALDH1A1 P00352 1/20 0.35
AR P10275 2/20 0.34
KMT2A Q03164 2/20 0.34
TSHR P16473 1/20 0.34
LMNA P02545 2/20 0.33
CYP1A2 P05177 1/20 0.33
MEN1 O00255 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL6177217 0.87 TLR7 (0.39) IGF1RCYP3A4GAACYP2C9CYP2C19
SCHEMBL6177581 0.87 IGF1R (0.50) IGF1R
SCHEMBL6172182 0.85 LMNA (0.44) IGF1RCYP3A4GAACYP2C9CYP2C19
SCHEMBL6174108 0.85 NPC1 (0.39) IGF1RCYP3A4GAACYP2C9CYP2C19
SCHEMBL6176511 0.85 NAMPT (0.43) IGF1R
SCHEMBL6175130 0.84 GRM5 (0.43) IGF1RGAACYP2C9ALDH1A1TSHR
SCHEMBL6173886 0.84 IGF1R (0.40) IGF1RCYP3A4GAACYP2C9CYP2C19
SCHEMBL6176335 0.83 CYP3A4 (0.46) IGF1RCYP3A4GAACYP2C9CYP2C19
SCHEMBL6174030 0.83 IGF1R (0.39) IGF1RGAACYP2C9ALDH1A1LMNA
SCHEMBL2932075 0.83 IGF1R (0.57) 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