SCHEMBL398252

SCHEMBL398252

CC(=Cc1ccccc1S(=O)(=O)NC(C)C)C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 1/20 0.44
NPSR1 Q6W5P4 2/20 0.42
KDM4E B2RXH2 1/20 0.42
APEX1 P27695 8/20 0.41
CASP1 P29466 1/20 0.38
SLC1A3 P43003 1/20 0.38
SLC1A2 P43004 1/20 0.38
SLC1A1 P43005 1/20 0.38
ALDH1A1 P00352 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
SCHEMBL398251 1.00 AKR1C3 (0.44) AKR1C3NPSR1KDM4EAPEX1CASP1
SCHEMBL393612 0.84 AKR1C3 (0.47) AKR1C3APEX1
SCHEMBL393614 0.84 AKR1C3 (0.47) AKR1C3APEX1
SCHEMBL397625 0.81 CA12 (0.47) AKR1C3APEX1ALDH1A1
SCHEMBL397623 0.81 CA12 (0.47) AKR1C3APEX1ALDH1A1
SCHEMBL396301 0.80 CA12 (0.47) AKR1C3APEX1ALDH1A1
SCHEMBL396299 0.80 CA12 (0.47) AKR1C3APEX1ALDH1A1
SCHEMBL8812676 0.79 AKR1C3 (0.52) AKR1C3KDM4EAPEX1
SCHEMBL4803011 0.79 AKR1C3 (0.52) AKR1C3KDM4EAPEX1
SCHEMBL396807 0.78 CA12 (0.58) AKR1C3APEX1

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