SCHEMBL398053

SCHEMBL398053

C/C(=C\c1ccccc1NS(C)(=O)=O)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.49
AKR1C3 P42330 1/20 0.47
GAA P10253 1/20 0.43
ALDH1A1 P00352 2/20 0.43
KDM4E B2RXH2 1/20 0.43
HPGD P15428 1/20 0.43
HSD17B10 Q99714 1/20 0.43
KEAP1 Q14145 3/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
NR3C1 P04150 1/20 0.42
APEX1 P27695 5/20 0.41
MCL1 Q07820 1/20 0.41
EP300 Q09472 1/20 0.41
KAT2B Q92831 1/20 0.41
KAT8 Q9H7Z6 1/20 0.41
MMP2 P08253 1/20 0.40
TSHR P16473 1/20 0.40
NFE2L2 Q16236 1/20 0.40

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
SCHEMBL398055 1.00 KMT2A (0.49) KMT2AAKR1C3GAAALDH1A1KDM4E
SCHEMBL396115 0.85 PSIP1 (0.47) KMT2AAKR1C3GAAALDH1A1KDM4E
SCHEMBL396113 0.85 PSIP1 (0.47) KMT2AAKR1C3GAAALDH1A1KDM4E
SCHEMBL398528 0.85 CYP2C9 (0.51) KMT2AGAAALDH1A1TSHR
SCHEMBL398530 0.85 CYP2C9 (0.51) KMT2AGAAALDH1A1TSHR
SCHEMBL396511 0.80 CYP2C9 (0.64) GAAALDH1A1KDM4EKEAP1L3MBTL1
SCHEMBL396512 0.80 CYP2C9 (0.64) GAAALDH1A1KDM4EKEAP1L3MBTL1
SCHEMBL23638096 0.80 AKR1C3 (0.53) AKR1C3ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL1405343 0.79 LMNA (0.53) KMT2AGAAALDH1A1KDM4EHPGD
SCHEMBL1405342 0.79 LMNA (0.53) KMT2AGAAALDH1A1KDM4EHPGD

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