SCHEMBL29490395

SCHEMBL29490395

COc1c(F)c(Cn2cccn2)cc(F)c1C#N

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ KAT7 O95251 10/20 0.45
▸ KAT6A Q92794 10/20 0.45
▸ KAT6B Q8WYB5 7/20 0.45
▸ KAT5 Q92993 3/20 0.38
▸ KAT8 Q9H7Z6 3/20 0.38
▸ SCN9A Q15858 2/20 0.35
▸ PDE4B Q07343 2/20 0.35
▸ MAPT P10636 3/20 0.34
▸ MEN1 O00255 2/20 0.34
▸ KMT2A Q03164 2/20 0.34
▸ ALDH1A1 P00352 2/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.34
▸ KDM4E B2RXH2 1/20 0.34
▸ PKM P14618 1/20 0.34
▸ GAA P10253 1/20 0.34
▸ BRD4 O60885 1/20 0.34

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
SCHEMBL22802414 1.00 KAT7 (0.45) KAT7KAT6AKAT6BKAT5KAT8
SCHEMBL31432542 0.89 KAT7 (0.36) KAT7KAT6AKAT6BKAT5KAT8
SCHEMBL31371951 0.88 KAT7 (0.36) KAT7KAT6AKAT6BKAT5KAT8
SCHEMBL31432470 0.88 KAT7 (0.36) KAT7KAT6AKAT6BKAT5KAT8
SCHEMBL31432516 0.88 KAT7 (0.36) KAT7KAT6AKAT6BKAT5KAT8
SCHEMBL31432574 0.87 KAT7 (0.38) KAT7KAT6AKAT6BKAT5KAT8
SCHEMBL31432519 0.86 KAT7 (0.37) KAT7KAT6AKAT6BKAT5KAT8
SCHEMBL25565517 0.81 BRD4 (0.39) KAT7KAT6AKAT6BKAT5KAT8
SCHEMBL31371880 0.81 GAA (0.39) KAT7KAT6AKAT6BKAT5KAT8
SCHEMBL25214173 0.79 KAT7 (0.39) KAT7KAT6AKAT6BKAT5KAT8

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114364672-B Benzisoxazole sulfonamide derivatives 辉瑞大药厂 2024-09-06 — — CN disclosed
EP-3986890-A1 BENZISOXAZOLE SULFONAMIDE DERIVATIVES Pfizer Inc. (US) 2022-04-27 — — EP disclosed
CN-114364672-A Benzisoxazole sulfonamide derivatives 辉瑞大药厂 2022-04-15 — — CN disclosed
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