SCHEMBL30433935

SCHEMBL30433935

COc1cc2nccc(Oc3ccc([N+](=O)[O-])c(Cl)c3)c2cc1C(N)=O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 14/20 0.61
MET P08581 7/20 0.61
TEK Q02763 7/20 0.61
AURKB Q96GD4 6/20 0.61
AURKA O14965 5/20 0.61
PDGFRA P16234 6/20 0.61
RET P07949 5/20 0.61
PDGFRB P09619 3/20 0.61
KIT P10721 2/20 0.61
FGFR1 P11362 2/20 0.61
FLT1 P17948 2/20 0.61
FLT4 P35916 2/20 0.61
ABL1 P00519 2/20 0.61
RIPK2 O43353 1/20 0.61
ERN1 O75460 1/20 0.61
STK10 O94804 1/20 0.61
MAP3K6 O95382 1/20 0.61
ESR1 P03372 1/20 0.61
ADORA3 P0DMS8 1/20 0.61
BCR P11274 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
SCHEMBL19957006 1.00 KDR (0.61) KDRMETTEKAURKBAURKA
SCHEMBL19957087 0.91 KDR (0.52) KDRMETTEKAURKBAURKA
SCHEMBL20927330 0.91 KDR (0.64) KDRMETTEKAURKBAURKA
SCHEMBL19957375 0.90 KDR (0.53) KDRMETTEKAURKBAURKA
SCHEMBL1896046 0.89 KDR (0.62) KDRMETTEKAURKBAURKA
SCHEMBL1893998 0.89 KDR (0.61) KDRMETTEKAURKBAURKA
SCHEMBL19957076 0.88 KDR (0.47) KDRMETTEKAURKBAURKA
SCHEMBL25307750 0.88 PDGFRA (0.62) KDRPDGFRAPDGFRBFGFR2EGFR
SCHEMBL31616944 0.88 PDGFRA (0.62) KDRPDGFRAPDGFRBFGFR2EGFR
SCHEMBL1894083 0.87 KDR (0.59) KDRMETTEKAURKBAURKA

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119143669-A Novel 7-methoxy-4-phenoxyquinoline-6-carboxamide compound and application thereof 辽宁大学 2024-12-17 CN disclosed
CN-117624044-A Preparation method of lenvatinib 山东新时代药业有限公司 2024-03-01 CN disclosed
CN-117343007-A Preparation method of lenvatinib 山东新时代药业有限公司 2024-01-05 CN disclosed
CN-116239531-A Preparation method of lenvatinib 山东新时代药业有限公司 2023-06-09 CN disclosed