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Sugi Predict / Compounds / SCHEMBL6173549

SCHEMBL6173549

SCHEMBL6173549

CC(c1ccncc1F)C1(C(C)c2ccncc2F)NC(=O)N(c2ccc(SC(F)(F)F)cc2)C1=O

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ IGF1R P08069 14/20 0.43
▸ AR P10275 3/20 0.36
▸ ALDH1A1 P00352 1/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ CYP2C9 P11712 1/20 0.33
▸ CYP2C19 P33261 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
SCHEMBL6174310 0.90 IGF1R (0.43) IGF1RARALDH1A1CYP3A4GAA
SCHEMBL6174921 0.90 IGF1R (0.43) IGF1RARALDH1A1CYP3A4GAA
SCHEMBL6173174 0.88 IGF1R (0.44) IGF1RARALDH1A1
SCHEMBL6173913 0.86 IGF1R (0.43) IGF1RARALDH1A1CYP3A4GAA
SCHEMBL6173753 0.86 IGF1R (0.43) IGF1RAR
SCHEMBL6174315 0.86 IGF1R (0.41) IGF1RARALDH1A1CYP3A4GAA
SCHEMBL6174958 0.86 IGF1R (0.43) IGF1RARALDH1A1
SCHEMBL6171813 0.85 IGF1R (0.41) IGF1RARALDH1A1CYP3A4GAA
SCHEMBL6177840 0.85 IGF1R (0.43) IGF1RAR
SCHEMBL6173832 0.85 IGF1R (0.40) IGF1RARALDH1A1

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