SCHEMBL31254883

SCHEMBL31254883

CC(C)n1cc(C(F)(F)F)nc1-c1ccc(COc2nc(Cl)ncc2Br)cc1F

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ USP1 O94782 7/20 0.43
▸ WDR48 Q8TAF3 7/20 0.43
▸ HDAC1 Q13547 13/20 0.40
▸ HDAC6 Q9UBN7 13/20 0.40
▸ HDAC5 Q9UQL6 13/20 0.40
▸ HDAC8 Q9BY41 5/20 0.40

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
SCHEMBL31254911 0.89 USP1 (0.43) USP1WDR48HDAC1HDAC6HDAC5
SCHEMBL31254682 0.88 USP1 (0.42) USP1HDAC1HDAC6HDAC5HDAC8
SCHEMBL31254863 0.79 USP1 (0.41) USP1HDAC1HDAC6HDAC5HDAC8
SCHEMBL25254428 0.77 USP1 (0.44) USP1WDR48HDAC1HDAC6HDAC5
SCHEMBL22143253 0.77 USP1 (0.44) USP1WDR48HDAC1HDAC6HDAC5
SCHEMBL31255089 0.77 USP1 (0.42) USP1HDAC1HDAC6HDAC5HDAC8
SCHEMBL22143252 0.77 USP1 (0.48) USP1WDR48HDAC1HDAC6
SCHEMBL22143093 0.77 USP1 (0.49) USP1WDR48
SCHEMBL31254707 0.76 USP1 (0.45) USP1HDAC1HDAC6HDAC5HDAC8
SCHEMBL31254615 0.76 USP1 (0.48) USP1WDR48

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-2024233665-A1 COMPOUNDS AND THEIR USE AGAINST CANCER TANGO THERAPEUTICS, INC. (US) 2024-11-14 — — WO disclosed
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