SCHEMBL7468017

SCHEMBL7468017

C=CCOC(=O)c1ccc(Cn2c(=O)n(S(=O)(=O)c3ccc(Cl)cc3)c(=O)c3ccc(Cl)cc32)cc1

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 3/20 0.45
HDAC1 Q13547 2/20 0.45
HDAC8 Q9BY41 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
HPGD P15428 1/20 0.40
MAPT P10636 3/20 0.38
KDM4E B2RXH2 1/20 0.38
CMA1 P23946 1/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
MAPK1 P28482 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
MAPK8 P45983 2/20 0.36
PARG Q86W56 1/20 0.36
NOD2 Q9HC29 1/20 0.36
NOD1 Q9Y239 1/20 0.36
PTGS2 P35354 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
SCHEMBL7472835 0.91 SMN1; SMN2 (0.43) HDAC6HDAC1HDAC8SMN1; SMN2HPGD
SCHEMBL7467191 0.87 L3MBTL1 (0.45) SMN1; SMN2MAPTMEN1KMT2AL3MBTL1
SCHEMBL7466686 0.85 CYP3A4 (0.38) HDAC6HDAC1HDAC8SMN1; SMN2HPGD
SCHEMBL7468517 0.84 HDAC6 (0.52) HDAC6HDAC1HDAC8SMN1; SMN2MAPT
SCHEMBL7467186 0.81 NOD1 (0.36) HDAC6HDAC1HDAC8HPGDMAPT
SCHEMBL7467945 0.80 AKR1B1 (0.39) HDAC6HDAC1HDAC8SMN1; SMN2HPGD
SCHEMBL7472590 0.79 HDAC6 (0.54) HDAC6HDAC1HDAC8SMN1; SMN2HPGD
SCHEMBL7461329 0.79 CMA1 (0.46) HDAC6HDAC1HDAC8SMN1; SMN2HPGD
SCHEMBL7460713 0.78 MAPK8 (0.55) HDAC6HDAC1HDAC8SMN1; SMN2HPGD
SCHEMBL7464054 0.78 CMA1 (0.48) SMN1; SMN2HPGDMAPTKDM4ECMA1

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