SCHEMBL7466216

SCHEMBL7466216

CCOC(=O)c1ccc(Cl)cc1NC(=O)NS(=O)(=O)c1ccccc1C#N

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
P2RY12 Q9H244 11/20 0.47
MAPT P10636 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
TSHR P16473 1/20 0.43
FBP1 P09467 1/20 0.42
ALDH1A1 P00352 2/20 0.42
KDM4E B2RXH2 1/20 0.42
HSD17B10 Q99714 1/20 0.42
GAA P10253 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
CYP3A4 P08684 1/20 0.41
CYP2C9 P11712 1/20 0.41
GPR119 Q8TDV5 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
SCHEMBL7465474 0.93 P2RY12 (0.47) P2RY12MAPTTDP1KDM4EHSD17B10
SCHEMBL7523406 0.86 GRIK1 (0.54) FBP1
SCHEMBL7469874 0.77 GRIK1 (0.51)
SCHEMBL3456352 0.75 KDM4E (0.52) MAPTALDH1A1KDM4EHSD17B10GAA
SCHEMBL7459836 0.73 HRH3 (0.52) MAPTTDP1ALDH1A1KDM4EHSD17B10
SCHEMBL11010057 0.72 ALDH1A1 (0.56) ALDH1A1KDM4EL3MBTL1CYP2C9
SCHEMBL3779399 0.70 ALDH1A1 (0.57) MAPTTDP1TSHRALDH1A1KDM4E
SCHEMBL8563548 0.70 ALDH1A1 (0.41) P2RY12MAPTTDP1TSHRALDH1A1
SCHEMBL9078899 0.69 ALDH1A1 (0.48) P2RY12MAPTTDP1TSHRALDH1A1
SCHEMBL14217003 0.69 MAPK1 (0.52) MAPTTSHRALDH1A1KDM4EGAA

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