SCHEMBL4690757

SCHEMBL4690757

COc1ccc(N2Cc3cnc(N(C(=O)[C@@H](N)CC(C)C)c4ccccc4)nc3N(c3ccccc3)C2=O)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FGFR4 P22455 8/20 0.39
EGFR P00533 8/20 0.39
PDGFRB P09619 3/20 0.39
FGFR1 P11362 3/20 0.39
PDGFRA P16234 3/20 0.39
FGFR2 P21802 3/20 0.39
FGFR3 P22607 3/20 0.39
KDR P35968 3/20 0.39
FYN P06241 2/20 0.39
MAPK1 P28482 2/20 0.39
EPHB3 P54753 2/20 0.39
NR1H4 Q96RI1 2/20 0.35
PRKACA P17612 1/20 0.34
PRKACG P22612 1/20 0.34
PRKACB P22694 1/20 0.34
KDM4E B2RXH2 1/20 0.33
ESR1 P03372 1/20 0.33
POLB P06746 1/20 0.33
NR4A1 P22736 1/20 0.33
APEX1 P27695 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
Acetic Acid SCHEMBL4686845 0.98 FGFR4 (0.38) FGFR4EGFRPDGFRBFGFR1PDGFRA
SCHEMBL4689937 0.92 FGFR4 (0.40) FGFR4EGFRPDGFRBFGFR1PDGFRA
SCHEMBL4686791 0.91 FGFR4 (0.39) FGFR4EGFRPDGFRBFGFR1PDGFRA
SCHEMBL6706766 0.89 EGFR (0.38) FGFR4EGFRPDGFRBFGFR1PDGFRA
SCHEMBL4686754 0.89 EGFR (0.38) FGFR4EGFRPDGFRBFGFR1PDGFRA
SCHEMBL14290437 0.89 EGFR (0.38) FGFR4EGFRPDGFRBFGFR1PDGFRA
SCHEMBL6212461 0.89 EGFR (0.38) FGFR4EGFRPDGFRBFGFR1PDGFRA
Acetic Acid SCHEMBL4687570 0.88 EGFR (0.37) FGFR4EGFRPDGFRBFGFR1PDGFRA
SCHEMBL4686694 0.87 FGFR4 (0.39) FGFR4EGFRPDGFRBFGFR1PDGFRA
SCHEMBL4686744 0.86 FGFR4 (0.45) FGFR4EGFRPDGFRBFGFR1PDGFRA

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-1556384-B1 PYRIMIDO COMPOUNDS HAVING ANTIPROLIFERATIVE ACTIVITY HOFFMANN LA ROCHE (CH) 2008-02-20 EP claimed