SCHEMBL7470103

SCHEMBL7470103

CC(=O)N(c1cccc2ncccc12)n1c(=O)n(S(=O)(=O)c2ccc(Cl)cc2)c(=O)c2ccc(Cl)cc21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH3A1 P30838 4/20 0.41
HPGD P15428 2/20 0.41
TSHR P16473 2/20 0.41
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
HTT P42858 1/20 0.41
HSD17B10 Q99714 1/20 0.41
NOD1 Q9Y239 2/20 0.39
PTGDR2 Q9Y5Y4 2/20 0.39
PSEN1 P49768 1/20 0.37
PSEN2 P49810 1/20 0.37
APH1B Q8WW43 1/20 0.37
NCSTN Q92542 1/20 0.37
APH1A Q96BI3 1/20 0.37
PSENEN Q9NZ42 1/20 0.37
CMA1 P23946 1/20 0.36
MET P08581 2/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
CLK1 P49759 1/20 0.35

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
SCHEMBL7463804 0.83 ALDH3A1 (0.41) ALDH3A1HPGDTSHRKDM4EALDH1A1
SCHEMBL7465172 0.83 ALDH3A1 (0.41) ALDH3A1HPGDTSHRKDM4EALDH1A1
SCHEMBL7468036 0.81 NOD1 (0.39) ALDH3A1HPGDTSHRKDM4EALDH1A1
SCHEMBL7472829 0.81 CMA1 (0.45) ALDH3A1HPGDTSHRKDM4EALDH1A1
SCHEMBL7468094 0.80 CMA1 (0.41) ALDH3A1HPGDTSHRKDM4EALDH1A1
SCHEMBL8784743 0.80 ALDH3A1 (0.43) ALDH3A1HPGDTSHRKDM4EALDH1A1
SCHEMBL7465241 0.79 CMA1 (0.39) ALDH3A1HPGDTSHRKDM4EALDH1A1
SCHEMBL7460693 0.79 CMA1 (0.40) ALDH3A1HPGDTSHRKDM4EALDH1A1
SCHEMBL7468000 0.77 CMA1 (0.42) ALDH3A1HPGDTSHRKDM4EALDH1A1
SCHEMBL7460791 0.77 TP53 (0.39) ALDH3A1HPGDTSHRKDM4EALDH1A1

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