SCHEMBL397676

SCHEMBL397676

C=C(Cc1ccc(NS(=O)(=O)c2ccccc2)cc1)C(=O)O

nearest known ligand 0.68

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 5/20 0.68
HDAC8 Q9BY41 5/20 0.68
HDAC4 P56524 1/20 0.57
HTR6 P50406 1/20 0.56
MEN1 O00255 3/20 0.56
KMT2A Q03164 3/20 0.56
ALDH1A1 P00352 3/20 0.56
PKM P14618 1/20 0.56
KEAP1 Q14145 2/20 0.54
IL1RN P18510 1/20 0.54
ERAP1 Q9NZ08 1/20 0.54
LMNA P02545 1/20 0.53
AR P10275 1/20 0.50
POLB P06746 1/20 0.50
CA12 O43570 1/20 0.50
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
CA9 Q16790 1/20 0.50

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
SCHEMBL396740 0.94 HDAC1 (0.59) HDAC1HDAC8HDAC4HTR6MEN1
SCHEMBL397357 0.87 ALDH1A1 (0.64) HDAC1HDAC8HDAC4MEN1KMT2A
SCHEMBL396811 0.86 LMNA (0.62) HDAC1HDAC8HDAC4MEN1KMT2A
SCHEMBL5202198 0.85 HDAC1 (0.71) HDAC1HDAC8HDAC4HTR6MEN1
SCHEMBL396990 0.85 HTR6 (0.59) HDAC1HDAC8HDAC4HTR6MEN1
SCHEMBL396887 0.85 HTR6 (0.62) HDAC1HDAC8HDAC4HTR6MEN1
SCHEMBL5205017 0.84 HDAC1 (0.75) HDAC1HDAC8HDAC4HTR6MEN1
SCHEMBL14812106 0.81 HDAC8 (1.00) HDAC1HDAC8HDAC4HTR6MEN1
SCHEMBL397628 0.80 HPGD (0.56) ALDH1A1KEAP1LMNAAR
SCHEMBL398078 0.79 HPGD (0.57) HDAC1HDAC8ALDH1A1LMNAAR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8101332-B2 Negative-working lithographic printing plate precursor and method of lithographic printing using same FUJIFILM CORPORATION (JP) 2012-01-24 US disclosed
US-20090246688-A1 NEGATIVE-WORKING LITHOGRAPHIC PRINTING PLATE PRECURSOR AND METHOD OF LITHOGRAPHIC PRINTING USING SAME FUJIFILM CORPORATION (JP) 2009-10-01 US disclosed
EP-2105298-A1 Negative-working lithographic printing plate precursor and method of lithographic printing using same Fujifilm Corporation (JP) 2009-09-30 EP disclosed