SCHEMBL21291728

SCHEMBL21291728

COc1cc2nccc(Oc3ccc(NC(=O)c4cc(C#CC(C)(C)O)cn(-c5ccccc5)c4=O)nc3)c2cc1OC

nearest known ligand 0.72

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PTK2B Q14289 11/20 0.72
PTK2 Q05397 5/20 0.72
MET P08581 5/20 0.61
IGF1R P08069 1/20 0.61
KDR P35968 1/20 0.61
AXL P30530 1/20 0.60
MERTK Q12866 1/20 0.60
SYK P43405 1/20 0.58
EIF2AK3 Q9NZJ5 2/20 0.57
EIF2AK4 Q9P2K8 1/20 0.57

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
Trifluoroacetic Acid SCHEMBL19511903 0.97 PTK2B (0.67) PTK2BPTK2METIGF1RKDR
SCHEMBL19511965 0.93 PTK2B (0.62) PTK2BPTK2METIGF1RKDR
SCHEMBL19512004 0.93 PTK2B (0.70) PTK2BPTK2METIGF1RKDR
SCHEMBL19511905 0.90 PTK2B (0.66) PTK2BPTK2METIGF1RKDR
SCHEMBL19511548 0.88 PTK2B (0.73) PTK2BPTK2METIGF1RKDR
SCHEMBL19511988 0.86 PTK2B (0.77) PTK2BPTK2METIGF1RKDR
SCHEMBL19511441 0.85 PTK2B (0.80) PTK2BPTK2METIGF1RKDR
SCHEMBL19511748 0.85 PTK2B (0.78) PTK2BPTK2METIGF1RKDR
SCHEMBL198979 0.83 PTK2B (1.00) PTK2BPTK2METIGF1RKDR
SCHEMBL19511587 0.83 SYK (0.76) PTK2BPTK2METIGF1RKDR

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-3239147-B1 QUINOLINE DERIVATIVE ONO PHARMACEUTICAL CO (JP) 2019-08-28 EP claimed