SCHEMBL31620876

SCHEMBL31620876

Cc1ccc(C(=O)Nc2ccc(CN3CCN(C)CC3)c(C(F)(F)F)c2)c(NCc2ccc(N)nc2)c1

nearest known ligand 0.58

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ KIT P10721 9/20 0.58
▸ BRAF P15056 8/20 0.56
▸ EGFR P00533 7/20 0.56
▸ ABL1 P00519 1/20 0.52
▸ ABL2 P42684 1/20 0.52
▸ CSF1R P07333 1/20 0.52
▸ RET P07949 1/20 0.52

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
SCHEMBL31620784 0.87 BRAF (0.73) KITBRAFEGFRCSF1R
SCHEMBL31620840 0.82 KIT (0.76) KITABL1ABL2RET
SCHEMBL5900585 0.81 ABL1 (0.57) KITBRAFEGFRABL1CSF1R
SCHEMBL31620739 0.78 BRAF (0.86) KITBRAFEGFRCSF1R
SCHEMBL27082370 0.76 KIT (0.63) KITBRAFEGFRABL1RET
SCHEMBL28021485 0.76 KIT (0.72) KITBRAFEGFRABL1CSF1R
SCHEMBL5900504 0.75 EGFR (0.63) KITBRAFEGFRABL1CSF1R
SCHEMBL31620732 0.75 KIT (0.59) KITBRAFEGFRABL1RET
SCHEMBL14318406 0.75 KIT (0.77) KITBRAFEGFRABL1CSF1R
SCHEMBL29562197 0.75 KIT (0.77) KITBRAFEGFRABL1CSF1R

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-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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