SCHEMBL7465247

SCHEMBL7465247

O=C(Cn1c(=O)n(S(=O)(=O)c2ccc(Cl)cc2)c(=O)c2ccc(Cl)cc21)C1=CCCC=C1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CMA1 P23946 1/20 0.40
PSEN1 P49768 2/20 0.36
PSEN2 P49810 2/20 0.36
APH1B Q8WW43 2/20 0.36
NCSTN Q92542 2/20 0.36
APH1A Q96BI3 2/20 0.36
PSENEN Q9NZ42 2/20 0.36
AKR1B1 P15121 2/20 0.35
AKR1A1 P14550 1/20 0.35
PTGDR2 Q9Y5Y4 3/20 0.34
PTGDR Q13258 1/20 0.34
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
HPGD P15428 1/20 0.34
TSHR P16473 1/20 0.34
ALDH3A1 P30838 1/20 0.34
HTT P42858 1/20 0.34
HSD17B10 Q99714 1/20 0.34
MAPT P10636 1/20 0.34
HDAC6 Q9UBN7 2/20 0.33

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
SCHEMBL7465874 0.81 AKR1B1 (0.50) CMA1PSEN1PSEN2APH1BNCSTN
SCHEMBL7465240 0.80 CMA1 (0.44) CMA1PSEN1PSEN2APH1BNCSTN
SCHEMBL7463225 0.77 CMA1 (0.42) CMA1PSEN1PSEN2APH1BNCSTN
SCHEMBL7472833 0.76 MAPT (0.48) CMA1ALDH1A1TSHRHTTMAPT
SCHEMBL7470400 0.75 AKR1B1 (0.49) CMA1PSEN1PSEN2APH1BNCSTN
SCHEMBL7471563 0.75 PPARG (0.48) CMA1PSEN1PSEN2APH1BNCSTN
SCHEMBL7467388 0.75 PSEN1 (0.42) CMA1PSEN1PSEN2APH1BNCSTN
SCHEMBL7467040 0.74 CMA1 (0.43) CMA1PSEN1PSEN2APH1BNCSTN
SCHEMBL7563746 0.74 MAPT (0.49) KDM4EALDH1A1HPGDMAPTHDAC6
SCHEMBL7459066 0.74 KMT2A (0.54) ALDH1A1TSHRHTTMAPT

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