SCHEMBL7469484

SCHEMBL7469484

C=CCOC(=O)c1cccc(S(=O)(=O)N=C=O)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.42
GAA P10253 2/20 0.39
MAPT P10636 2/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
ALDH1A1 P00352 1/20 0.38
TSHR P16473 1/20 0.38
HSD17B10 Q99714 1/20 0.38
SNCA P37840 1/20 0.38
CA1 P00915 2/20 0.37
CA2 P00918 2/20 0.37
F2 P00734 2/20 0.37
PRSS1 P07477 2/20 0.37
PRSS2 P07478 2/20 0.37
PRSS3 P35030 2/20 0.37
LMNA P02545 1/20 0.37
HPGD P15428 1/20 0.37
HTT P42858 1/20 0.37
KDM4E B2RXH2 1/20 0.37
TDP1 Q9NUW8 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
SCHEMBL7460913 0.84 SNCA (0.47) CYP3A4GAAMEN1KMT2AALDH1A1
SCHEMBL3779761 0.83 CYP3A4 (0.38) CYP3A4KMT2AALDH1A1TSHRHSD17B10
SCHEMBL460642 0.80 CYP3A4 (0.47) CYP3A4GAAMAPTMEN1KMT2A
SCHEMBL7835511 0.79 F2 (0.50) GAAKMT2AALDH1A1TSHRCA1
SCHEMBL3788206 0.78 SNCA (0.39) CYP3A4GAAMAPTMEN1KMT2A
SCHEMBL157805 0.78 CYP3A4 (0.61) CYP3A4MEN1KMT2AALDH1A1TSHR
SCHEMBL16372021 0.78 CYP3A4 (0.61) CYP3A4MEN1KMT2AALDH1A1TSHR
SCHEMBL7613584 0.76 CYP3A4 (0.46) CYP3A4GAAMAPTMEN1KMT2A
Benzene SCHEMBL29140663 0.76 CYP3A4 (0.59) CYP3A4GAAMAPTMEN1KMT2A
SCHEMBL9576387 0.75 CYP3A4 (0.58) CYP3A4MEN1KMT2AALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0795548-B1 QUINAZOLINE DERIVATIVES AND USE THEREOF SUNTORY LTD (JP) 2002-07-03 EP disclosed
EP-0721944-B1 IMIDAZOLIDINE DERIVATIVE AND USE THEREOF SUNTORY LTD (JP) 2001-01-17 EP disclosed
US-5814631-A CHYMASE INHIBITOR, CARDIVASCULAR SUNTORY LIMITED (JP) 1998-09-29 US disclosed
US-5691335-A CARDIOVASCULAR DISORDERS SUNTORY LIMITED (JP) 1997-11-25 US disclosed
EP-0795548-A1 QUINAZOLINE DERIVATIVES AND USE THEREOF SUNTORY LIMITED (JP) 1997-09-17 EP disclosed
EP-0721944-A1 IMIDAZOLIDINE DERIVATIVE AND USE THEREOF SUNTORY LIMITED (JP) 1996-07-17 EP disclosed