SCHEMBL28428914

SCHEMBL28428914

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

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ PDGFRA P16234 11/20 0.49
▸ KDR P35968 8/20 0.49
▸ KIT P10721 3/20 0.49
▸ PDGFRB P09619 1/20 0.49
▸ MET P08581 5/20 0.49
▸ MST1R Q04912 3/20 0.49
▸ SRC P12931 1/20 0.47
▸ AXL P30530 1/20 0.47
▸ AURKA O14965 1/20 0.47
▸ ABL1 P00519 1/20 0.47
▸ LCK P06239 1/20 0.47
▸ LYN P07948 1/20 0.47
▸ TEK Q02763 1/20 0.47
▸ AURKB Q96GD4 1/20 0.47
▸ FGFR2 P21802 1/20 0.47
▸ KRAS P01116 1/20 0.47
▸ SOS1 Q07889 1/20 0.47

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
SCHEMBL30646048 0.91 PDGFRA (0.50) PDGFRAKDRKITPDGFRBMET
SCHEMBL28427821 0.87 MET (0.48) PDGFRAKDRKITPDGFRBMET
SCHEMBL30646064 0.87 PDGFRA (0.52) PDGFRAKDRKITMETMST1R
SCHEMBL28423297 0.87 PDGFRA (0.52) PDGFRAKDRKITMETMST1R
SCHEMBL28421305 0.87 PIK3CD (0.54) PDGFRAKDRKITMETAURKA
SCHEMBL30646019 0.86 PDGFRA (0.62) PDGFRAKDRKITPDGFRBMET
SCHEMBL29111053 0.86 PDGFRA (0.62) PDGFRAKDRKITPDGFRBMET
SCHEMBL28420947 0.85 KDR (0.51) PDGFRAKDRKITPDGFRBMET
SCHEMBL23923068 0.83 PDGFRA (0.69) PDGFRAKDRKITPDGFRBMET
SCHEMBL25130670 0.80 KRAS (0.53) METKRASSOS1

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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