SCHEMBL6173312

SCHEMBL6173312

CN1CCC(c2cc(C(NC=O)C3(C)NC(=O)N(c4ccc(S(=O)(=O)C(F)(F)F)cc4)C3=O)ccn2)CC1

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 2/20 0.34
AR P10275 1/20 0.33
CCNT1 O60563 2/20 0.32
CDK9 P50750 2/20 0.32
HTR6 P50406 2/20 0.32
HRH4 Q9H3N8 1/20 0.31
KMT2A Q03164 1/20 0.31
JAK2 O60674 1/20 0.30
JAK1 P23458 1/20 0.30

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
SCHEMBL6171937 0.83 IGF1R (0.41) IGF1R
SCHEMBL6175215 0.82 CTSS (0.34) IGF1RKMT2A
SCHEMBL6172419 0.74 HRH4 (0.38) IGF1RARHRH4KMT2A
SCHEMBL6173929 0.70 IGF1R (0.36) IGF1RARHRH4KMT2A
SCHEMBL6174365 0.70 HTR6 (0.35) HTR6
SCHEMBL6173482 0.69 IGF1R (0.39) IGF1RARHRH4KMT2A
SCHEMBL6175147 0.69 HTR2A (0.34) HTR6
SCHEMBL6173034 0.69 IGF1R (0.38) IGF1R
SCHEMBL6171670 0.69 IGF1R (0.38) IGF1R
SCHEMBL6175073 0.68 IGF1R (0.38) IGF1RARHRH4KMT2A

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