SCHEMBL8035247

SCHEMBL8035247

N#CC(CCCCCC(=O)NO)(c1ccc(F)cc1)c1ccc(F)cc1

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 16/20 0.54
HDAC1 Q13547 7/20 0.54
HDAC3 O15379 5/20 0.54
HDAC2 Q92769 5/20 0.54
HDAC8 Q9BY41 4/20 0.49
HDAC4 P56524 2/20 0.49
HDAC7 Q8WUI4 2/20 0.49
HDAC10 Q969S8 2/20 0.49
HDAC11 Q96DB2 2/20 0.49
HDAC9 Q9UKV0 2/20 0.49
HDAC5 Q9UQL6 2/20 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
SCHEMBL8045870 0.95 HDAC6 (0.49) HDAC6HDAC1HDAC3HDAC2HDAC8
SCHEMBL8035262 0.88 HDAC1 (0.51) HDAC6HDAC1HDAC3HDAC2HDAC8
SCHEMBL8044351 0.86 HDAC1 (0.54) HDAC6HDAC1HDAC3HDAC2HDAC8
SCHEMBL8035139 0.86 HDAC1 (0.51) HDAC6HDAC1HDAC3HDAC2HDAC8
SCHEMBL8035137 0.86 HDAC1 (0.51) HDAC6HDAC1HDAC3HDAC2HDAC8
SCHEMBL8044651 0.85 HDAC1 (0.50) HDAC6HDAC1HDAC3HDAC2HDAC8
SCHEMBL8052846 0.83 HDAC1 (0.56) HDAC6HDAC1HDAC3HDAC2HDAC8
SCHEMBL8045041 0.83 HDAC1 (0.56) HDAC6HDAC1HDAC3HDAC2HDAC8
SCHEMBL8045767 0.83 HDAC1 (0.42) HDAC6HDAC1HDAC3HDAC2HDAC8
SCHEMBL8049639 0.82 HDAC1 (0.48) HDAC6HDAC1HDAC3HDAC2HDAC8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0749957-B1 Aromatic hydroxamic acid compounds, their production and use TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2000-04-26 EP claimed
US-5891916-A ANTINEUROGEGERATIVE AGENT TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1999-04-06 US claimed
EP-0749957-A1 Aromatic hydroxamic acid compounds, their production and use Takeda Chemical Industries, Ltd. (JP) 1996-12-27 EP claimed
EP-0749957-B1 Aromatic hydroxamic acid compounds, their production and use TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2000-04-26 EP disclosed
US-5891916-A ANTINEUROGEGERATIVE AGENT TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1999-04-06 US disclosed
EP-0749957-A1 Aromatic hydroxamic acid compounds, their production and use Takeda Chemical Industries, Ltd. (JP) 1996-12-27 EP disclosed