SCHEMBL12438527

SCHEMBL12438527

C=C(/C=C(/CNc1nc(Nc2cc(C3CC3)[nH]n2)cc(OCCN2CCOCC2)n1)ON)C(C)C

nearest known ligand 0.64

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 19/20 0.64

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
SCHEMBL12438489 0.94 IGF1R (0.61) IGF1R
SCHEMBL12438675 0.86 IGF1R (0.60) IGF1R
SCHEMBL4472934 0.78 IGF1R (1.00) IGF1R
SCHEMBL14161978 0.78 IGF1R (0.61) IGF1R
SCHEMBL12438567 0.77 IGF1R (0.68) IGF1R
SCHEMBL14050427 0.75 IGF1R (0.51) IGF1R
SCHEMBL15109563 0.75 IGF1R (0.59) IGF1R
SCHEMBL12438467 0.74 IGF1R (0.48) IGF1R
SCHEMBL14311659 0.73 IGF1R (0.64) IGF1R
SCHEMBL12439851 0.73 IGF1R (0.62) 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