SCHEMBL31091696

SCHEMBL31091696

Cn1ncc(N[C@@H]2C[C@H](c3ccc(C(=O)O)cc3)CN(C3CC3)C2)c(Br)c1=O

nearest known ligand 0.62

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ KAT2B Q92831 19/20 0.62
▸ BRD9 Q9H8M2 3/20 0.62
▸ KAT2A Q92830 2/20 0.62
▸ BRD1 O95696 1/20 0.62
▸ ACHE P22303 1/20 0.62
▸ BRPF1 P55201 1/20 0.62
▸ BPTF Q12830 1/20 0.62
▸ BRD7 Q9NPI1 1/20 0.62
▸ BAZ2B Q9UIF8 1/20 0.62
▸ BRPF3 Q9ULD4 1/20 0.62
▸ CCR2 P41597 1/20 0.35
▸ KCNH2 Q12809 1/20 0.35

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
SCHEMBL30830559 0.89 KAT2B (0.79) KAT2BBRD9KAT2ABRD1ACHE
SCHEMBL31091738 0.88 KAT2B (0.54) KAT2BBRD9KAT2ABRD1ACHE
SCHEMBL31091709 0.85 KAT2B (0.60) KAT2BBRD9KAT2ABRD1ACHE
SCHEMBL30830598 0.80 KAT2B (0.62) KAT2BBRD9KAT2ABRD1ACHE
SCHEMBL30830560 0.79 KAT2B (0.73) KAT2BBRD9KAT2ABRD1ACHE
SCHEMBL30830795 0.79 KAT2B (0.73) KAT2BBRD9KAT2ABRD1ACHE
SCHEMBL30830474 0.78 KAT2B (0.62) KAT2BBRD9KAT2ABRD1ACHE
SCHEMBL23682859 0.77 KAT2B (1.00) KAT2BBRD9KAT2ABRD1ACHE
SCHEMBL23682853 0.77 KAT2B (1.00) KAT2BBRD9KAT2ABRD1ACHE
SCHEMBL31091718 0.77 KAT2B (0.43) KAT2BBRD9KAT2ABRD1ACHE

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-2024220843-A1 TECHNOLOGIES TARGETING CELL STATES AURON THERAPEUTICS, INC. (US) 2024-10-24 — — WO disclosed
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