SCHEMBL29137432

SCHEMBL29137432

COc1cc2nccc(Oc3ccc(N)c(O)c3)c2cc1OC

nearest known ligand 0.69

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PDGFRA P16234 2/20 0.69
PDGFRB P09619 1/20 0.69
KDR P35968 3/20 0.63
FGFR2 P21802 3/20 0.58
EGFR P00533 1/20 0.58
AURKA O14965 1/20 0.56
ABL1 P00519 1/20 0.56
LCK P06239 1/20 0.56
LYN P07948 1/20 0.56
MET P08581 1/20 0.56
TEK Q02763 1/20 0.56
AURKB Q96GD4 1/20 0.56

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
SCHEMBL4365396 0.89 PDGFRB (0.76) PDGFRAPDGFRBKDRFGFR2EGFR
SCHEMBL168048 0.88 PDGFRB (0.79) PDGFRAPDGFRBKDRFGFR2EGFR
SCHEMBL167759 0.86 PDGFRB (0.71) PDGFRAPDGFRBKDRFGFR2EGFR
SCHEMBL4470477 0.85 PDGFRA (0.74) PDGFRAPDGFRBKDRFGFR2
SCHEMBL1875038 0.85 PDGFRA (0.69) PDGFRAPDGFRBKDRFGFR2EGFR
SCHEMBL30467929 0.85 PDGFRA (0.69) PDGFRAPDGFRBKDRFGFR2EGFR
SCHEMBL4482576 0.85 PDGFRA (0.69) PDGFRAPDGFRBKDRFGFR2EGFR
SCHEMBL3898473 0.84 PDGFRA (0.64) PDGFRAPDGFRBKDRFGFR2EGFR
SCHEMBL5208153 0.83 PDGFRA (0.56) PDGFRAPDGFRBKDRFGFR2MET
SCHEMBL14967467 0.82 PDGFRB (0.66) PDGFRAPDGFRBKDRFGFR2EGFR

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
CN-117327061-A Preparation method of tivalzanib hydrochloride and related substances 武汉迈德森医药科技股份有限公司 2024-01-02 CN disclosed