SCHEMBL7470720

SCHEMBL7470720

CC(C)(C)OC(=O)Cn1c(=O)n(S(=O)(=O)c2ccccc2)c(=O)c2ccc(Cl)cc21

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSEN1 P49768 3/20 0.43
PSEN2 P49810 3/20 0.43
APH1B Q8WW43 3/20 0.43
NCSTN Q92542 3/20 0.43
APH1A Q96BI3 3/20 0.43
PSENEN Q9NZ42 3/20 0.43
PPARG P37231 3/20 0.43
PPARA Q07869 3/20 0.43
PPARD Q03181 2/20 0.39
KDM4E B2RXH2 2/20 0.39
ALDH1A1 P00352 2/20 0.39
HDAC6 Q9UBN7 2/20 0.39
HPGD P15428 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
MAPK8 P45983 1/20 0.38
MAPK9 P45984 1/20 0.38
AKR1A1 P14550 1/20 0.38
AKR1B1 P15121 1/20 0.38
HTR6 P50406 2/20 0.37
TSHR P16473 1/20 0.37

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
SCHEMBL7467388 0.94 PSEN1 (0.42) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL7472701 0.91 PSEN1 (0.42) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL7465212 0.90 PPARG (0.43) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL7461621 0.89 KDM4E (0.38) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL7456131 0.87 HDAC6 (0.36) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL7470400 0.85 AKR1B1 (0.49) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL7467347 0.85 PSEN1 (0.36) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL7460868 0.83 GAA (0.36) PSEN1PSEN2APH1BNCSTNAPH1A
Bromide SCHEMBL7465782 0.81 PSEN1 (0.37) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL7465874 0.80 AKR1B1 (0.50) PSEN1PSEN2APH1BNCSTNAPH1A

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