SCHEMBL7465215

SCHEMBL7465215

CC(=O)N(c1ccc(C(=O)OC(C)(C)C)cc1C(=O)OC(C)(C)C)n1c(=O)n(S(=O)(=O)c2ccc(Cl)cc2)c(=O)c2ccc(Cl)cc21

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CMA1 P23946 1/20 0.35
PSEN1 P49768 1/20 0.34
PSEN2 P49810 1/20 0.34
APH1B Q8WW43 1/20 0.34
NCSTN Q92542 1/20 0.34
APH1A Q96BI3 1/20 0.34
PSENEN Q9NZ42 1/20 0.34
GABRA1 P14867 1/20 0.33
GABRG2 P18507 1/20 0.33
GABRB3 P28472 1/20 0.33
GABRA5 P31644 1/20 0.33
NOD1 Q9Y239 2/20 0.33
NOD2 Q9HC29 1/20 0.33
MAPK8 P45983 2/20 0.32
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
HPGD P15428 1/20 0.32
TSHR P16473 1/20 0.32
ALDH3A1 P30838 1/20 0.32
HTT P42858 1/20 0.32

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
SCHEMBL7566229 0.85 CMA1 (0.38) CMA1PSEN1PSEN2APH1BNCSTN
SCHEMBL7472829 0.79 CMA1 (0.45) CMA1PSEN1PSEN2APH1BNCSTN
SCHEMBL7471528 0.78 CMA1 (0.40) CMA1PSEN1PSEN2APH1BNCSTN
SCHEMBL7465172 0.78 ALDH3A1 (0.41) CMA1PSEN1PSEN2APH1BNCSTN
SCHEMBL8784743 0.76 ALDH3A1 (0.43) CMA1PSEN1PSEN2APH1BNCSTN
SCHEMBL7465217 0.76 S1PR2 (0.39) ALDH1A1HSD17B10MAPT
SCHEMBL7472664 0.76 GAA (0.38) CMA1PSEN1PSEN2APH1BNCSTN
SCHEMBL7468000 0.75 CMA1 (0.42) CMA1PSEN1PSEN2APH1BNCSTN
SCHEMBL7463375 0.75 PSEN1 (0.39) CMA1PSEN1PSEN2APH1BNCSTN
SCHEMBL7468094 0.75 CMA1 (0.41) CMA1PSEN1PSEN2APH1BNCSTN

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