SCHEMBL9504819

SCHEMBL9504819

CN(O)C(=O)c1ccc(C2CCCCC2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC8 Q9BY41 2/20 0.53
HDAC6 Q9UBN7 2/20 0.53
HDAC1 Q13547 1/20 0.53
HAO1 Q9UJM8 1/20 0.50
DEGS1 O15121 2/20 0.48
HDAC3 O15379 1/20 0.48
HDAC11 Q96DB2 1/20 0.48
SMN1; SMN2 Q16637 2/20 0.45
ALDH1A1 P00352 1/20 0.45
MAPT P10636 1/20 0.45
MCHR1 Q99705 2/20 0.43
NAMPT P43490 1/20 0.43
KMO O15229 1/20 0.42
SLC6A7 Q99884 1/20 0.42
KDM4E B2RXH2 1/20 0.41
GLA P06280 1/20 0.41
HTT P42858 1/20 0.41
KMT2A Q03164 1/20 0.41
HIF1A Q16665 1/20 0.41
TDP1 Q9NUW8 1/20 0.41

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
SCHEMBL7287722 0.80 HAO1 (0.51) HDAC8HDAC6HDAC1HAO1DEGS1
SCHEMBL21628738 0.80 ALDH1A1 (0.65) HDAC8HDAC6HDAC1HAO1DEGS1
SCHEMBL21628651 0.80 ALDH1A1 (0.65) HDAC8HDAC6HDAC1HAO1DEGS1
SCHEMBL6822733 0.78 HDAC8 (0.59) HDAC8HDAC6HDAC1HAO1DEGS1
SCHEMBL14231550 0.78 HDAC8 (0.59) HDAC8HDAC6HDAC1HAO1DEGS1
SCHEMBL6822864 0.78 HDAC8 (0.59) HDAC8HDAC6HDAC1HAO1DEGS1
SCHEMBL15081033 0.78 HDAC8 (0.59) HDAC8HDAC6HDAC1HAO1DEGS1
SCHEMBL12337677 0.78 HDAC8 (0.59) HDAC8HDAC6HDAC1HAO1DEGS1
SCHEMBL13445251 0.78 HDAC8 (0.59) HDAC8HDAC6HDAC1HAO1DEGS1
SCHEMBL28595922 0.78 HDAC8 (0.59) HDAC8HDAC6HDAC1HAO1DEGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0161939-B1 ARYLHYDROXAMATES E.R. Squibb & Sons, Inc. (US) 1993-07-21 EP disclosed
CN-85104470-A The method for preparing arythydroxamtes 1986-10-01 CN disclosed
US-4607053-A L2POXYGENASE INHIBITORS E. R. SQUIBB & SONS, INC. (US) 1986-08-19 US disclosed
EP-0161939-A2 Arylhydroxamates E.R. Squibb & Sons, Inc. (US) 1985-11-21 EP disclosed