SCHEMBL31620780

SCHEMBL31620780

Cc1ccc(C(=O)Nc2ccc(CN3CCN(C)CC3)c(C(F)(F)F)c2)cc1-c1ccc2c(cnn2C)c1

nearest known ligand 0.64

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ KIT P10721 4/20 0.64
▸ ABL1 P00519 3/20 0.63
▸ RET P07949 1/20 0.63
▸ BRAF P15056 12/20 0.62
▸ EGFR P00533 9/20 0.62
▸ KDR P35968 1/20 0.62
▸ CSF1R P07333 2/20 0.59

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
SCHEMBL4905442 0.88 KIT (0.67) KITABL1RETBRAFEGFR
SCHEMBL31620781 0.86 ABL1 (0.75) KITABL1RETBRAFEGFR
SCHEMBL4906580 0.86 CSF1R (0.72) KITABL1RETBRAFEGFR
SCHEMBL4911783 0.85 BRAF (0.68) KITABL1RETBRAFEGFR
SCHEMBL4911133 0.85 BRAF (0.67) KITABL1RETBRAFEGFR
SCHEMBL13772031 0.85 BRAF (0.79) KITABL1RETBRAFEGFR
SCHEMBL31620787 0.85 BRAF (0.64) KITABL1RETBRAFEGFR
SCHEMBL31620774 0.84 BRAF (0.69) KITABL1RETBRAFEGFR
SCHEMBL31620727 0.84 KIT (0.63) KITABL1RETBRAFEGFR
SCHEMBL31620761 0.84 BRAF (0.63) KITABL1RETBRAFEGFR

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-120136781-A ROR 1-targeted inhibitor and synthesis method and application thereof 北京大学 2025-06-13 — — CN claimed
CN-120136781-A ROR 1-targeted inhibitor and synthesis method and application thereof 北京大学 2025-06-13 — — CN disclosed
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