SCHEMBL28937951

SCHEMBL28937951

Nc1cccc(C(=O)c2ccc(OCC(=O)Nc3cccnc3)cc2)c1

nearest known ligand 0.78

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 3/20 0.78
▸ GALR3 O60755 1/20 0.78
▸ TDP1 Q9NUW8 1/20 0.78
▸ KCNH2 Q12809 3/20 0.63
▸ NOTUM Q6P988 7/20 0.62
▸ POLB P06746 2/20 0.57
▸ KDR P35968 1/20 0.51
▸ KMT2A Q03164 2/20 0.49
▸ MEN1 O00255 1/20 0.49
▸ NPC1 O15118 2/20 0.49
▸ LMNA P02545 2/20 0.48
▸ MAPK1 P28482 1/20 0.48
▸ HTT P42858 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
SCHEMBL30117329 1.00 RAB9A (0.78) RAB9AGALR3TDP1KCNH2NOTUM
SCHEMBL28937965 0.90 RAB9A (0.82) RAB9AGALR3TDP1KCNH2NOTUM
SCHEMBL30117338 0.90 RAB9A (0.82) RAB9AGALR3TDP1KCNH2NOTUM
SCHEMBL30117346 0.88 RAB9A (0.79) RAB9AGALR3TDP1KCNH2NOTUM
SCHEMBL28937961 0.88 RAB9A (0.79) RAB9AGALR3TDP1KCNH2NOTUM
SCHEMBL30117313 0.87 RAB9A (0.78) RAB9AGALR3TDP1KCNH2NOTUM
SCHEMBL28937964 0.87 GALR3 (0.78) RAB9AGALR3TDP1KCNH2NOTUM
SCHEMBL30117330 0.87 GALR3 (0.78) RAB9AGALR3TDP1KCNH2NOTUM
SCHEMBL31251218 0.87 RAB9A (0.78) RAB9AGALR3TDP1KCNH2NOTUM
SCHEMBL28937967 0.87 RAB9A (0.78) RAB9AGALR3TDP1KCNH2NOTUM

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-115611805-A Benzophenone compound and preparation method and application thereof 山东大学 2023-01-17 — — CN disclosed
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