SCHEMBL24247607

SCHEMBL24247607

Cc1ccc(Cn2c(=O)n(CCc3cccc(C(F)(F)F)c3)c(=O)c3ccccc32)cc1

nearest known ligand 0.73

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ HDAC1 Q13547 5/20 0.73
▸ HDAC8 Q9BY41 5/20 0.73
▸ HDAC6 Q9UBN7 5/20 0.73
▸ MAPT P10636 5/20 0.63
▸ GAA P10253 1/20 0.59
▸ HDAC11 Q96DB2 4/20 0.58
▸ TP53 P04637 3/20 0.57
▸ THRB P10828 2/20 0.53
▸ TSHR P16473 1/20 0.53
▸ MEN1 O00255 1/20 0.53
▸ KMT2A Q03164 1/20 0.53
▸ MELK Q14680 1/20 0.51
▸ HPGD P15428 1/20 0.49
▸ SMN1; SMN2 Q16637 1/20 0.49

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
SCHEMBL30317704 0.86 HDAC6 (0.80) HDAC1HDAC8HDAC6MAPTHDAC11
SCHEMBL24247592 0.86 MAPT (0.84) HDAC1HDAC8HDAC6MAPTGAA
SCHEMBL24031120 0.84 HDAC6 (1.00) HDAC1HDAC8HDAC6HDAC11MELK
SCHEMBL24031181 0.84 THRB (0.71) HDAC1HDAC8HDAC6MAPTGAA
SCHEMBL24030777 0.82 HDAC6 (0.78) HDAC1HDAC8HDAC6HDAC11TP53
SCHEMBL30317680 0.81 HDAC6 (0.81) HDAC1HDAC8HDAC6HDAC11MELK
SCHEMBL24031223 0.81 HDAC6 (0.75) HDAC1HDAC8HDAC6MAPTHDAC11
SCHEMBL24247586 0.81 HDAC1 (0.69) HDAC1HDAC8HDAC6MAPTHDAC11
SCHEMBL16674525 0.79 TSHR (0.73) HDAC1HDAC8HDAC6MAPTGAA
Hydrochloric Acid SCHEMBL29381790 0.78 HDAC6 (0.70) HDAC1HDAC8HDAC6HDAC11TP53

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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