SCHEMBL24666972

SCHEMBL24666972

CCn1c(=O)c(-c2cnccc2CCCn2c(=O)c(-c3cnccc3C)cc3cnc(NC(=O)[C@H]4C[C@H]4F)cc32)cc2cnc(NC(=O)[C@H]3C[C@@H]3F)cc21

nearest known ligand 0.54

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ ABL1 P00519 10/20 0.54
▸ MAP4K1 Q92918 10/20 0.48
▸ LRRK2 Q5S007 1/20 0.44

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
SCHEMBL24666426 0.95 ABL1 (0.56) ABL1MAP4K1LRRK2
SCHEMBL24666966 0.95 ABL1 (0.56) ABL1MAP4K1LRRK2
SCHEMBL24667324 0.95 ABL1 (0.56) ABL1MAP4K1LRRK2
SCHEMBL24667319 0.91 ABL1 (0.64) ABL1MAP4K1LRRK2
SCHEMBL24666973 0.91 ABL1 (0.64) ABL1MAP4K1LRRK2
SCHEMBL24667075 0.89 ABL1 (0.56) ABL1MAP4K1LRRK2
SCHEMBL24665005 0.83 ABL1 (0.61) ABL1MAP4K1LRRK2
SCHEMBL24664995 0.83 ABL1 (0.61) ABL1MAP4K1LRRK2
SCHEMBL24666251 0.82 ABL1 (0.67) ABL1MAP4K1LRRK2
SCHEMBL24666255 0.82 ABL1 (0.67) ABL1MAP4K1LRRK2

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
WO-2022236319-A1 NAPHTHYRIDONE COMPOUNDS FOR INHIBITION OF RAF KINASES AND/OR BCR-ABL TYROSINE KINASES ENLIVEN THERAPEUTICS, INC. (US) 2022-11-10 — — WO disclosed
Send feedback