SCHEMBL6173736

SCHEMBL6173736

CC(c1cc(N)nc2ccccc12)C1(C(C)c2cc(N)nc3ccccc23)NC(=O)N(c2ccc(SC(F)(F)F)cc2)C1=O

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 12/20 0.38
BACE1 P56817 2/20 0.34
PDE2A O00408 5/20 0.34
LMNA P02545 1/20 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
SCHEMBL6171062 0.90 IGF1R (0.35) IGF1RPDE2ALMNA
SCHEMBL6171361 0.90 IGF1R (0.37) IGF1RPDE2ALMNA
SCHEMBL6177111 0.88 IGF1R (0.40) IGF1RPDE2ALMNA
SCHEMBL6173653 0.85 BACE1 (0.38) IGF1RBACE1PDE2A
SCHEMBL6172238 0.85 KDM4E (0.39) IGF1RPDE2A
SCHEMBL6174520 0.80 IGF1R (0.38) IGF1R
SCHEMBL6172631 0.79 IGF1R (0.42) IGF1RBACE1
SCHEMBL6172638 0.78 LMNA (0.39) IGF1RBACE1PDE2ALMNA
SCHEMBL6174700 0.76 IGF1R (0.39) IGF1R
SCHEMBL6174595 0.76 IGF1R (0.52) 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