SCHEMBL28423297

SCHEMBL28423297

COc1cc2c(Oc3ccc(NNC(N)=O)cc3)ccnc2cc1OC1CCN(C(C)=O)CC1

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PDGFRA P16234 14/20 0.52
▸ KDR P35968 8/20 0.52
▸ KIT P10721 4/20 0.51
▸ MET P08581 4/20 0.51
▸ MST1R Q04912 3/20 0.51
▸ AXL P30530 2/20 0.49
▸ SRC P12931 1/20 0.49
▸ FLT3 P36888 1/20 0.49
▸ AURKB Q96GD4 1/20 0.49
▸ FGFR2 P21802 1/20 0.48

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
SCHEMBL30646064 1.00 PDGFRA (0.52) PDGFRAKDRKITMETMST1R
SCHEMBL28433303 0.88 KDR (0.53) PDGFRAKDRKIT
SCHEMBL30646043 0.88 KDR (0.53) PDGFRAKDRKIT
SCHEMBL28428914 0.87 PDGFRA (0.49) PDGFRAKDRKITMETMST1R
SCHEMBL30646048 0.87 PDGFRA (0.50) PDGFRAKDRKITMETMST1R
SCHEMBL29111070 0.84 SOS1 (0.39) PDGFRAMETMST1RAXLSRC
SCHEMBL28427821 0.84 MET (0.48) PDGFRAKDRKITMETMST1R
SCHEMBL28420947 0.83 KDR (0.51) PDGFRAKDRKITMETMST1R
SCHEMBL29111053 0.82 PDGFRA (0.62) PDGFRAKDRKITMETMST1R
SCHEMBL30646019 0.82 PDGFRA (0.62) PDGFRAKDRKITMETMST1R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111253385-B Heterocyclic compound, preparation method and application 遵义医科大学珠海校区 2023-11-24 — — CN disclosed
CN-111253385-A Heterocyclic compound, preparation method and application 遵义医科大学珠海校区 2020-06-09 — — CN disclosed
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