SCHEMBL30466487

SCHEMBL30466487

COc1ccc(C(=O)Nc2ccc(CN3CCN(C)CC3)c(C(F)(F)F)c2)cc1

nearest known ligand 0.70

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ KIT P10721 5/20 0.70
▸ BRAF P15056 7/20 0.68
▸ FGFR1 P11362 2/20 0.65
▸ KDR P35968 1/20 0.65
▸ SRC P12931 1/20 0.64
▸ EGFR P00533 6/20 0.63
▸ MAPT P10636 2/20 0.62
▸ KMT2A Q03164 1/20 0.62
▸ NPSR1 Q6W5P4 1/20 0.62
▸ ABL1 P00519 2/20 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
SCHEMBL14318406 0.89 KIT (0.77) KITBRAFEGFRABL1
SCHEMBL29562197 0.89 KIT (0.77) KITBRAFEGFRABL1
Hydrochloric Acid SCHEMBL29833672 0.88 KIT (0.75) KITBRAFEGFRABL1
SCHEMBL29562470 0.88 BRAF (0.82) KITBRAFFGFR1KDREGFR
SCHEMBL6184307 0.88 BRAF (0.82) KITBRAFFGFR1KDREGFR
SCHEMBL19500739 0.86 KIT (0.78) KITBRAFFGFR1EGFRABL1
SCHEMBL12871531 0.85 KIT (0.84) KITBRAFEGFRABL1
SCHEMBL24122650 0.84 KIT (0.79) KITBRAFFGFR1KDRSRC
SCHEMBL30011074 0.84 KIT (0.79) KITBRAFFGFR1KDRSRC
SCHEMBL21944007 0.83 KIT (0.81) KITBRAFEGFRABL1

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
CN-118908899-A FGFR4 inhibitor and preparation and application thereof 重庆医科大学 2024-11-08 — — CN disclosed
CN-115947693-B FGFR4 inhibitor and preparation and application thereof 重庆医科大学 2024-11-05 — — CN disclosed
CN-115947693-A FGFR4 inhibitor and preparation and application thereof 重庆医科大学 2023-04-11 — — CN disclosed
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