SCHEMBL7472808

SCHEMBL7472808

COC(=O)c1ccc(S(=O)(=O)N=C=O)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 6/20 0.53
CA2 P00918 6/20 0.53
CA12 O43570 5/20 0.53
CA9 Q16790 5/20 0.53
CA14 Q9ULX7 5/20 0.53
FBP1 P09467 1/20 0.50
POLB P06746 1/20 0.49
GLA P06280 1/20 0.48
TDP1 Q9NUW8 1/20 0.47
CA7 P43166 1/20 0.47
STS P08842 1/20 0.46
PTGS2 P35354 2/20 0.46
PTGS1 P23219 1/20 0.46
F2 P00734 1/20 0.45
PRSS1 P07477 1/20 0.45
PRSS2 P07478 1/20 0.45
PRSS3 P35030 1/20 0.45
HPGD P15428 1/20 0.45
ALDH1A1 P00352 1/20 0.44
GAA P10253 1/20 0.44

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
SCHEMBL11445224 0.83 KMT2A (0.55) CA1CA2CA12CA9CA14
SCHEMBL7835511 0.81 F2 (0.50) CA1CA2CA12CA9POLB
SCHEMBL5653955 0.78 F2 (0.37) F2PRSS1PRSS2PRSS3HPGD
SCHEMBL11374760 0.77 KDM4E (0.50) CA1CA2CA12CA9CA14
Methyl Benzoate SCHEMBL8167763 0.77 TSHR (0.63) CA1CA2FBP1POLBTDP1
SCHEMBL7833842 0.76 CYP4F2 (0.49) HPGDALDH1A1GAAMAPTHTT
SCHEMBL68518 0.76 POLB (0.74) CA1CA2CA12CA9CA14
SCHEMBL7460913 0.76 SNCA (0.47) CA1CA2CA12CA9CA14
SCHEMBL1945898 0.75 F2 (0.56) CA1CA2CA12CA9CA14
SCHEMBL2228992 0.74 CA1 (0.62) CA1CA2CA12CA9CA14

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 4 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-0885890-A1 SULFONYLUREIDOPYRAZOLE DERIVATIVES SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1998-12-23 EP disclosed
US-5814631-A CHYMASE INHIBITOR, CARDIVASCULAR SUNTORY LIMITED (JP) 1998-09-29 US disclosed
EP-0795548-A1 QUINAZOLINE DERIVATIVES AND USE THEREOF SUNTORY LIMITED (JP) 1997-09-17 EP disclosed