SCHEMBL398078

SCHEMBL398078

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

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HPGD P15428 7/20 0.57
LMNA P02545 2/20 0.57
HTT P42858 1/20 0.57
SMN1; SMN2 Q16637 1/20 0.57
MAPT P10636 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
AR P10275 1/20 0.46
NR3C2 P08235 1/20 0.45
KIF11 P52732 1/20 0.42
HDAC1 Q13547 1/20 0.41
HDAC8 Q9BY41 1/20 0.41
GAA P10253 1/20 0.40
ALDH1A1 P00352 1/20 0.40
POLB P06746 1/20 0.40
ALOX15 P16050 1/20 0.39
HSD17B10 Q99714 1/20 0.39

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
SCHEMBL397628 0.86 HPGD (0.56) HPGDLMNAHTTSMN1; SMN2AR
SCHEMBL1421898 0.83 HPGD (0.65) HPGDLMNAHTTSMN1; SMN2MAPT
SCHEMBL398544 0.82 ADRA2A (0.47) HPGDLMNAHTTSMN1; SMN2AR
SCHEMBL397676 0.79 HDAC1 (0.68) LMNAARHDAC1HDAC8ALDH1A1
SCHEMBL4161796 0.79 HPGD (0.62) HPGDLMNAHTTSMN1; SMN2MAPT
SCHEMBL397357 0.79 ALDH1A1 (0.64) HPGDLMNASMN1; SMN2MAPTHDAC1
SCHEMBL16799573 0.78 HPGD (0.61) HPGDLMNAHTTSMN1; SMN2MAPT
SCHEMBL3426193 0.77 CA2 (0.46) HPGDLMNAHTTGAAALDH1A1
SCHEMBL396740 0.76 HDAC1 (0.59) LMNAHDAC1HDAC8GAAALDH1A1
SCHEMBL6442701 0.76 ALDH1A1 (0.52) HPGDLMNASMN1; SMN2MAPTALDH1A1

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