SCHEMBL29911628

SCHEMBL29911628

O=c1c2c(F)cc(C3CC3)cc2ccn1-c1ccccc1CO

nearest known ligand 0.56

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 20/20 0.56

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
SCHEMBL1725249 0.85 BTK (0.62) BTK
SCHEMBL31077836 0.85 BTK (0.62) BTK
SCHEMBL17781684 0.83 BTK (0.48) BTK
SCHEMBL32667577 0.83 BTK (0.62) BTK
SCHEMBL1725875 0.78 BTK (0.48) BTK
SCHEMBL28076283 0.77 BTK (0.46) BTK
SCHEMBL29519783 0.76 BTK (0.48) BTK
SCHEMBL16754809 0.76 BTK (0.48) BTK
SCHEMBL17937550 0.76 BTK (0.56) BTK
SCHEMBL17923516 0.76 BTK (0.55) BTK

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-115023240-A Anticancer agent composition 卡尔那生物科学株式会社 2022-09-06 — — CN disclosed
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