SCHEMBL7832999

SCHEMBL7832999

CCC(=O)ONC(=O)CCCCCCc1nccc2ccccc12

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 8/20 0.48
HDAC3 O15379 7/20 0.48
HDAC8 Q9BY41 7/20 0.48
HDAC6 Q9UBN7 7/20 0.48
HDAC4 P56524 6/20 0.48
HDAC7 Q8WUI4 6/20 0.48
HDAC2 Q92769 6/20 0.48
HDAC10 Q969S8 6/20 0.48
HDAC11 Q96DB2 6/20 0.48
HDAC9 Q9UKV0 6/20 0.48
HDAC5 Q9UQL6 6/20 0.48
RAB9A P51151 1/20 0.37

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
SCHEMBL7831162 0.84 HDAC1 (0.48) HDAC1HDAC3HDAC8HDAC6HDAC4
SCHEMBL7833535 0.82 CNR2 (0.48) HDAC1HDAC3HDAC8HDAC6HDAC4
SCHEMBL7831579 0.82 CNR2 (0.48) HDAC1HDAC3HDAC8HDAC6HDAC4
SCHEMBL8651999 0.82 HDAC1 (0.44) HDAC1HDAC3HDAC8HDAC6HDAC4
SCHEMBL7833282 0.81 CDYL (0.46) HDAC1HDAC3HDAC8HDAC6HDAC4
SCHEMBL7832930 0.81 CDYL (0.46) HDAC1HDAC3HDAC8HDAC6HDAC4
SCHEMBL7833306 0.81 HDAC1 (0.62) HDAC1HDAC3HDAC8HDAC6HDAC4
SCHEMBL7829653 0.81 HDAC1 (0.62) HDAC1HDAC3HDAC8HDAC6HDAC4
SCHEMBL8798020 0.75 CYP1A2 (0.52) HDAC1HDAC3HDAC8HDAC6HDAC4
SCHEMBL7832214 0.75 HDAC1 (0.51) HDAC1HDAC3HDAC8HDAC6HDAC4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0737671-B1 Aromatic hydroxamic acid compounds, their production and use TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2001-12-12 EP disclosed
EP-0737671-A2 Aromatic hydroxamic acid compounds, their production and use Takeda Chemical Industries, Ltd. (JP) 1996-10-16 EP disclosed