SCHEMBL31108985

SCHEMBL31108985

Nc1ccc(-c2ccc(F)cc2)cc1NC(=O)c1ccc(S(=O)(=O)c2cncc(Cl)c2)cc1

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ HDAC2 Q92769 14/20 0.56
▸ HDAC1 Q13547 12/20 0.56
▸ HDAC3 O15379 10/20 0.48
▸ KCNH2 Q12809 2/20 0.44

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
SCHEMBL31109075 0.91 HDAC2 (0.60) HDAC2HDAC1HDAC3
SCHEMBL30474667 0.90 HDAC2 (0.54) HDAC2HDAC1HDAC3KCNH2
SCHEMBL25216642 0.90 HDAC2 (0.54) HDAC2HDAC1HDAC3KCNH2
SCHEMBL31108961 0.88 HDAC2 (0.56) HDAC2HDAC1HDAC3
SCHEMBL31108968 0.88 HDAC2 (0.61) HDAC2HDAC1HDAC3
SCHEMBL31109094 0.87 HDAC2 (0.72) HDAC2HDAC1HDAC3
SCHEMBL31109095 0.86 HDAC2 (0.53) HDAC2HDAC1HDAC3KCNH2
SCHEMBL31109025 0.86 HDAC2 (0.53) HDAC2HDAC1HDAC3
SCHEMBL31109017 0.86 HDAC1 (0.56) HDAC2HDAC1HDAC3
SCHEMBL31109116 0.86 HDAC2 (0.63) HDAC2HDAC1HDAC3

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
CN-118715206-A Novel HDAC inhibitors and therapeutic uses thereof 探戈医药股份有限公司 2024-09-27 — — CN disclosed
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