SCHEMBL31155899

SCHEMBL31155899

FC(F)(F)c1cn(C2CC2)c(-c2ccc(COc3nc(Cl)nc4ccoc34)cc2)n1

nearest known ligand 0.41

Predicted protein targets (top 5)

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
▸ HDAC5 Q9UQL6 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
SCHEMBL31138552 0.85 USP1 (0.33) USP1HDAC1HDAC8HDAC6HDAC5
SCHEMBL31138403 0.85 USP1 (0.42) USP1
SCHEMBL31155858 0.83 USP1 (0.42) USP1
SCHEMBL31138542 0.80 USP1 (0.41) USP1HDAC1HDAC8HDAC6
SCHEMBL31254974 0.79 USP1 (0.43) USP1HDAC1HDAC8HDAC6HDAC5
SCHEMBL31155874 0.78 USP1 (0.49) USP1
SCHEMBL31138445 0.78 USP1 (0.42) USP1
SCHEMBL31155889 0.75 USP1 (0.46) USP1
SCHEMBL31254997 0.75 USP1 (0.48) USP1
SCHEMBL31254882 0.73 USP1 (0.45) 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-2024208292-A1 UBIQUITIN-SPECIFIC PROTEASE 1 INHIBITOR, PREPARATION METHOD THEREFOR, AND MEDICAL USE THEREOF 江苏亚虹医药科技股份有限公司 2024-10-10 — — WO disclosed
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