SCHEMBL7472835

SCHEMBL7472835

C=CCOC(=O)c1cccc(Cn2c(=O)n(S(=O)(=O)c3ccc(Cl)cc3)c(=O)c3ccc(Cl)cc32)c1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.43
HPGD P15428 1/20 0.43
HDAC6 Q9UBN7 3/20 0.40
HDAC1 Q13547 2/20 0.39
HDAC8 Q9BY41 2/20 0.39
MAPT P10636 3/20 0.38
KDM4E B2RXH2 1/20 0.38
MAPK8 P45983 2/20 0.37
MAPK9 P45984 1/20 0.37
PARG Q86W56 2/20 0.36
CMA1 P23946 1/20 0.36
CCR2 P41597 1/20 0.36
NOD2 Q9HC29 1/20 0.35
NOD1 Q9Y239 1/20 0.35
MAPK1 P28482 1/20 0.35
L3MBTL1 Q9Y468 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
SCHEMBL7468017 0.91 HDAC6 (0.45) SMN1; SMN2HPGDHDAC6HDAC1HDAC8
SCHEMBL7472478 0.85 CCR2 (0.50) SMN1; SMN2HPGDHDAC6HDAC1HDAC8
SCHEMBL7466686 0.84 CYP3A4 (0.38) SMN1; SMN2HPGDHDAC6HDAC1HDAC8
SCHEMBL7467945 0.84 AKR1B1 (0.39) SMN1; SMN2HPGDHDAC6HDAC1HDAC8
SCHEMBL7465634 0.80 SMN1; SMN2 (0.49) SMN1; SMN2HPGDHDAC6HDAC1HDAC8
SCHEMBL7467191 0.80 L3MBTL1 (0.45) SMN1; SMN2MAPTL3MBTL1
SCHEMBL7460868 0.80 GAA (0.36) SMN1; SMN2HPGDHDAC6HDAC1HDAC8
SCHEMBL7460713 0.80 MAPK8 (0.55) SMN1; SMN2HPGDHDAC6HDAC1HDAC8
SCHEMBL8705102 0.78 GAA (0.38) SMN1; SMN2HPGDMAPTKDM4ENOD2
SCHEMBL7461866 0.78 MEN1 (0.48) SMN1; SMN2MAPTKDM4EMAPK1L3MBTL1

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