SCHEMBL2408190

SCHEMBL2408190

CC(C)C(NC(=O)c1ccccc1)c1ccc(C(=O)NO)cc1

nearest known ligand 0.91

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HDAC1 Q13547 9/20 0.91
▸ HDAC8 Q9BY41 7/20 0.58
▸ HDAC6 Q9UBN7 7/20 0.58
▸ HDAC3 O15379 4/20 0.56
▸ HDAC7 Q8WUI4 4/20 0.56
▸ HDAC2 Q92769 4/20 0.56
▸ CA12 O43570 1/20 0.56
▸ CA1 P00915 1/20 0.56
▸ IDO1 P14902 1/20 0.56
▸ ALOX15 P16050 1/20 0.56
▸ CA9 Q16790 1/20 0.56
▸ HSD17B10 Q99714 1/20 0.56
▸ NCOR2 Q9Y618 1/20 0.56
▸ ALDH1A1 P00352 5/20 0.56
▸ LMNA P02545 4/20 0.56
▸ SMN1; SMN2 Q16637 2/20 0.56
▸ HPGD P15428 1/20 0.55
▸ TP53 P04637 1/20 0.52
▸ HDAC4 P56524 3/20 0.52
▸ HDAC10 Q969S8 3/20 0.52

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
SCHEMBL2407097 0.93 HDAC1 (0.83) HDAC1HDAC8HDAC6HDAC3HDAC7
SCHEMBL2407996 0.93 HDAC1 (0.83) HDAC1HDAC8HDAC6HDAC3HDAC7
SCHEMBL2408207 0.86 HDAC1 (0.73) HDAC1HDAC8HDAC6HDAC3HDAC7
SCHEMBL2404840 0.85 HDAC1 (0.76) HDAC1HDAC8HDAC6HDAC3HDAC7
SCHEMBL2405287 0.85 HDAC1 (0.71) HDAC1HDAC8HDAC6HDAC3ALDH1A1
SCHEMBL2406380 0.84 HDAC1 (0.74) HDAC1HDAC8HDAC6HDAC3HDAC7
SCHEMBL2406452 0.84 HDAC1 (0.74) HDAC1HDAC8HDAC6HDAC3HDAC7
SCHEMBL2408419 0.84 HDAC1 (0.74) HDAC1HDAC8HDAC6HDAC3HDAC7
SCHEMBL2407415 0.84 SMN1; SMN2 (0.77) HDAC1HDAC8HDAC6HDAC3HDAC7
SCHEMBL16297617 0.84 HDAC1 (0.65) HDAC1HDAC8HDAC6HDAC3HDAC7

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
WO-2011106632-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2011-09-01 — — WO disclosed
Send feedback