SCHEMBL398043

SCHEMBL398043

C=CCCC(=O)ONS(=O)(=O)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TBXA2R P21731 3/20 0.42
MMP2 P08253 2/20 0.40
MMP13 P45452 2/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
MMP1 P03956 1/20 0.40
MMP9 P14780 1/20 0.40
MMP8 P22894 1/20 0.40
ALDH1A1 P00352 2/20 0.39
KAT6A Q92794 1/20 0.38
MCL1 Q07820 2/20 0.37
ADAMTS4 O75173 1/20 0.37
MMP14 P50281 1/20 0.37
ADAMTS5 Q9UNA0 1/20 0.37
BCAT1 P54687 1/20 0.37
SLC1A3 P43003 2/20 0.37
SLC1A2 P43004 2/20 0.37
SLC1A1 P43005 2/20 0.37
RAB9A P51151 1/20 0.37
LARS1 Q9P2J5 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
SCHEMBL10687684 0.80 ALDH1A1 (0.45) TBXA2RMMP2MMP13CA1CA2
SCHEMBL9670975 0.77 EGFR (0.50) TBXA2RMMP2MMP13CA1CA2
SCHEMBL4363071 0.77 KDM4E (0.38) TBXA2RALDH1A1RAB9A
SCHEMBL599971 0.77 EPHX2 (0.49) TBXA2RMMP13MMP1ALDH1A1KAT6A
SCHEMBL8707459 0.77 ALDH1A1 (0.53) ALDH1A1RAB9A
SCHEMBL7053278 0.76 BCAT1 (0.46) MMP2MMP13CA1CA2MMP1
SCHEMBL28510375 0.75 EGFR (0.48) MMP2MMP13CA1CA2MMP1
SCHEMBL7652696 0.74 ALDH1A1 (0.42) TBXA2RMMP2MMP13CA1CA2
SCHEMBL397304 0.73 ALDH1A1 (0.42) CA2ALDH1A1
SCHEMBL7657476 0.72 GBA1 (0.52) ALDH1A1RAB9A

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