SCHEMBL6173405

SCHEMBL6173405

CC(c1ccnc(C(=O)N2CCOCC2)c1)C1(C(C)c2ccnc(C(=O)N3CCOCC3)c2)NC(=O)N(c2ccc(SC(F)(F)F)cc2)C1=O

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 13/20 0.40
FKBP1A P62942 1/20 0.39
TACR1 P25103 1/20 0.38
PDE2A O00408 3/20 0.34
CCNT1 O60563 1/20 0.33
CDK9 P50750 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
SCHEMBL6173555 0.92 IGF1R (0.41) IGF1RTACR1PDE2A
SCHEMBL6173419 0.91 IGF1R (0.42) IGF1RTACR1PDE2A
SCHEMBL6173461 0.90 IGF1R (0.39) IGF1RTACR1PDE2A
SCHEMBL6178301 0.87 EPHX2 (0.41)
SCHEMBL6175941 0.87 PTGS2 (0.39) IGF1RTACR1SMN1; SMN2
SCHEMBL6174941 0.85 IGF1R (0.45) IGF1RPDE2A
SCHEMBL6174717 0.85 IGF1R (0.54) IGF1RPDE2A
SCHEMBL6173502 0.85 IGF1R (0.38) IGF1R
SCHEMBL17558356 0.83 IGF1R (0.56) IGF1RPDE2A
SCHEMBL6174371 0.81 IGF1R (0.44) IGF1RPDE2A

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