SCHEMBL31138542

SCHEMBL31138542

FC(F)(F)c1cn(C2CC2)c(-c2ccc(COc3nc(Cl)nc4ncccc34)cc2)n1

nearest known ligand 0.41

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ USP1 O94782 19/20 0.41
▸ HDAC1 Q13547 1/20 0.32
▸ HDAC8 Q9BY41 1/20 0.32
▸ HDAC6 Q9UBN7 1/20 0.32

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
SCHEMBL31138675 0.85 USP1 (0.33) USP1HDAC1HDAC6
SCHEMBL31138445 0.85 USP1 (0.42) USP1
SCHEMBL31537668 0.84 USP1 (0.44) USP1
SCHEMBL31138444 0.81 USP1 (0.35) USP1
SCHEMBL31537624 0.81 USP1 (0.38) USP1
SCHEMBL31155899 0.80 USP1 (0.41) USP1HDAC1HDAC8HDAC6
SCHEMBL31254974 0.79 USP1 (0.43) USP1HDAC1HDAC8HDAC6
SCHEMBL31138689 0.79 USP1 (0.51) USP1
SCHEMBL31537586 0.79 DGAT1 (0.52) USP1
SCHEMBL31155874 0.78 USP1 (0.49) USP1

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-2024233605-A1 COMPOUNDS AND THEIR USE AGAINST CANCER TANGO THERAPEUTICS, INC. (US) 2024-11-14 — — WO disclosed
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