SCHEMBL7469747

SCHEMBL7469747

O=C(O)c1cccc(S(=O)(=O)n2c(=O)[nH]c3cc(Cl)ccc3c2=O)c1.[NaH]

nearest known ligand 0.65

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CMA1 P23946 1/20 0.65
CA9 Q16790 3/20 0.47
CA12 O43570 2/20 0.47
AKR1C3 P42330 3/20 0.46
AKR1C1 Q04828 2/20 0.46
MAT2A P31153 1/20 0.45
ACLY P53396 1/20 0.44
ENPP2 Q13822 1/20 0.44
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
MAPT P10636 1/20 0.43
IL1RN P18510 1/20 0.43
FEN1 P39748 1/20 0.41
ALDH1A1 P00352 1/20 0.41

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
SCHEMBL7460037 0.99 CMA1 (0.67) CMA1CA9CA12AKR1C3AKR1C1
SCHEMBL7469742 0.89 CMA1 (0.69) CMA1CA9CA12AKR1C3AKR1C1
SCHEMBL7464440 0.88 CMA1 (0.77) CMA1CA9CA12ACLYCA1
SCHEMBL7461590 0.86 CMA1 (0.79) CMA1CA9CA12ACLYCA1
SCHEMBL7464965 0.85 CMA1 (0.85) CMA1CA9CA12CA1CA2
SCHEMBL3781496 0.84 CMA1 (0.71) CMA1CA9CA12CA1CA2
SCHEMBL3782983 0.83 CMA1 (0.63) CMA1CA9CA12CA1CA2
SCHEMBL3782209 0.82 CMA1 (0.71) CMA1CA9CA12CA1CA2
SCHEMBL3780426 0.82 CMA1 (0.67) CMA1CA9CA12CA1CA2
SCHEMBL7472700 0.81 CMA1 (0.55) CMA1CA9CA12CA1CA2

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 2 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-0795548-A1 QUINAZOLINE DERIVATIVES AND USE THEREOF SUNTORY LIMITED (JP) 1997-09-17 EP disclosed