SCHEMBL7227952

SCHEMBL7227952

COc1cc2nccc(Oc3ccc(Cl)cc3F)c2cc1C(=O)NCCc1ccc(Cl)cc1

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MET P08581 6/20 0.55
▸ DNMT3A Q9Y6K1 1/20 0.54
▸ AXL P30530 6/20 0.51
▸ HDAC1 Q13547 2/20 0.51
▸ HDAC6 Q9UBN7 2/20 0.51
▸ NLRP3 Q96P20 3/20 0.50
▸ KDR P35968 3/20 0.50
▸ PDGFRB P09619 1/20 0.50
▸ PDGFRA P16234 1/20 0.50
▸ MERTK Q12866 1/20 0.49

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
SCHEMBL7238249 0.83 MET (0.55) METAXLKDRPDGFRAMERTK
SCHEMBL372112 0.83 MET (0.69) METAXLKDRPDGFRA
SCHEMBL29693544 0.83 MET (0.69) METAXLKDRPDGFRA
SCHEMBL7237353 0.82 AXL (0.50) METAXL
SCHEMBL7230366 0.82 AXL (0.62) METAXLKDRPDGFRBPDGFRA
SCHEMBL7237343 0.81 AXL (0.58) METAXLKDRPDGFRBPDGFRA
SCHEMBL4459639 0.80 MET (0.65) METAXLKDRPDGFRA
SCHEMBL6431113 0.77 FGFR2 (0.60) METAXLKDRPDGFRBPDGFRA
SCHEMBL4365490 0.77 AXL (0.62) METAXLKDR
SCHEMBL1132290 0.76 MET (0.72) METAXLKDRPDGFRBPDGFRA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6630489-B1 Quinoline derivatives as tyrosine kinase inhibitors ASTRAZENECA AB (SE) 2003-10-07 — — US disclosed
EP-1157008-A1 QUINOLINE DERIVATIVES AS TYROSINE KINASE INHIBITORS AstraZeneca AB (SE) 2001-11-28 — — EP disclosed
WO-2000050405-A1 QUINOLINE DERIVATIVES AS TYROSINE KINASE INHIBITORS ASTRAZENECA AB (SE) 2000-08-31 — — WO disclosed
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