SCHEMBL7472823

SCHEMBL7472823

CC(C)(C)OC(=O)c1ccc(N)c(C(=O)OC(C)(C)C)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 2/20 0.48
CA12 O43570 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CA9 Q16790 1/20 0.46
CA14 Q9ULX7 1/20 0.46
MAPT P10636 4/20 0.45
KDM4E B2RXH2 4/20 0.45
ALDH1A1 P00352 4/20 0.45
HSD17B10 Q99714 3/20 0.45
GAA P10253 3/20 0.45
HPGD P15428 3/20 0.45
GLA P06280 1/20 0.45
CASP1 P29466 1/20 0.45
CASP7 P55210 1/20 0.45
ATM Q13315 1/20 0.45
GABRA1 P14867 1/20 0.44
GABRG2 P18507 1/20 0.44
GABRB3 P28472 1/20 0.44
GABRA3 P34903 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
SCHEMBL557180 0.90 CDC25B (0.47) ALOX15CA12CA1CA2CA9
SCHEMBL11090176 0.86 ALOX15 (0.53) ALOX15CA12CA1CA2CA9
SCHEMBL1185611 0.84 KMT2A (0.52) ALOX15CA12CA1CA2CA9
SCHEMBL828480 0.84 GABRA1 (0.48) ALOX15CA12CA1CA2CA9
SCHEMBL9470701 0.83 CA12 (0.50) ALOX15CA12CA1CA2CA9
SCHEMBL2403279 0.83 MAPT (0.47) ALOX15MAPTKDM4EALDH1A1HSD17B10
SCHEMBL1028144 0.83 ALOX15 (0.48) ALOX15CA12CA1CA2CA9
SCHEMBL357470 0.82 ALOX15 (0.45) ALOX15CA12CA1CA2CA9
SCHEMBL6817695 0.81 KDM4E (0.56) ALOX15MAPTKDM4EALDH1A1HSD17B10
SCHEMBL6351877 0.81 GABRG2 (0.43) ALOX15CA12CA1CA2CA9

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
EP-0795548-B1 QUINAZOLINE DERIVATIVES AND USE THEREOF SUNTORY LTD (JP) 2002-07-03 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