SCHEMBL24247605

SCHEMBL24247605

O=Cc1ccc(Cn2c(=O)n(CCc3ccc(C(=O)O)cc3)c(=O)c3ccccc32)cc1

nearest known ligand 0.67

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ HDAC6 Q9UBN7 19/20 0.67
▸ HDAC1 Q13547 18/20 0.67
▸ HDAC8 Q9BY41 17/20 0.67
▸ HDAC11 Q96DB2 15/20 0.67
▸ MELK Q14680 1/20 0.67
▸ HDAC3 O15379 1/20 0.61
▸ HDAC2 Q92769 1/20 0.61
▸ MAPT P10636 1/20 0.56

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
SCHEMBL24031113 0.85 HDAC6 (0.92) HDAC6HDAC1HDAC8HDAC11MELK
SCHEMBL30317732 0.82 HDAC6 (0.76) HDAC6HDAC1HDAC8HDAC11MELK
SCHEMBL28354241 0.80 HDAC6 (0.81) HDAC6HDAC1HDAC8HDAC11MELK
SCHEMBL28357694 0.80 HDAC6 (0.81) HDAC6HDAC1HDAC8HDAC11MELK
SCHEMBL24031144 0.80 HDAC6 (1.00) HDAC6HDAC1HDAC8HDAC11MELK
SCHEMBL28354076 0.80 HDAC6 (0.81) HDAC6HDAC1HDAC8HDAC11MELK
SCHEMBL16668021 0.79 HDAC1 (0.67) HDAC6HDAC1HDAC8HDAC11MELK
SCHEMBL24030751 0.79 HDAC6 (0.70) HDAC6HDAC1HDAC8HDAC11MELK
SCHEMBL24030718 0.78 HDAC6 (0.76) HDAC6HDAC1HDAC8HDAC11MELK
SCHEMBL30317740 0.77 HDAC6 (0.77) HDAC6HDAC1HDAC8HDAC11MELK

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
EP-3624804-B1 HISTONE DEACETYLASES (HDACS) INHIBITORS ANNJI PHARM CO LTD (TW) 2022-02-16 — — EP disclosed
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