SCHEMBL12438428

SCHEMBL12438428

Oc1ccc(-c2cc(CNc3nccc(Nc4cc(C5CC5)[nH]n4)n3)on2)cc1

nearest known ligand 0.84

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 20/20 0.84
FGFR1 P11362 1/20 0.61
KDR P35968 1/20 0.61

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
SCHEMBL11341645 0.91 IGF1R (1.00) IGF1R
SCHEMBL14050663 0.91 IGF1R (0.84) IGF1RFGFR1KDR
SCHEMBL11349367 0.89 IGF1R (1.00) IGF1RFGFR1KDR
SCHEMBL4305959 0.83 IGF1R (1.00) IGF1RFGFR1KDR
SCHEMBL4011011 0.81 IGF1R (1.00) IGF1RFGFR1
SCHEMBL11340066 0.80 IGF1R (1.00) IGF1R
SCHEMBL4012244 0.80 IGF1R (0.78) IGF1RFGFR1KDR
SCHEMBL2318459 0.79 IGF1R (1.00) IGF1R
SCHEMBL15256330 0.79 IGF1R (0.87) IGF1R
SCHEMBL4564747 0.79 IGF1R (1.00) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1841760-B1 PYRIMIDINE DERIVATIVES AS KINASE MODULATORS AND METHOD OF USE EXELIXIS INC (US) 2011-08-10 EP disclosed