SCHEMBL9256424

SCHEMBL9256424

CC(=O)c1ccc2c(c1)OCC(C(N)=O)O2

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.53
POLB P06746 2/20 0.46
APEX1 P27695 1/20 0.46
RECQL P46063 1/20 0.46
TSHR P16473 1/20 0.45
NPC1 O15118 4/20 0.45
RAB9A P51151 4/20 0.45
MAPT P10636 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
NISCH Q9Y2I1 1/20 0.43

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
SCHEMBL7199605 0.94 KDM4E (0.53) KDM4EPOLBAPEX1RECQLTSHR
SCHEMBL9412075 0.88 KDM4E (0.53) KDM4EPOLBAPEX1RECQLNPC1
SCHEMBL9255523 0.82 CYP4F2 (0.47) KDM4EPOLBAPEX1RECQLTSHR
SCHEMBL9412114 0.82 KDM4E (0.53) KDM4EPOLBAPEX1RECQLNPC1
SCHEMBL16601605 0.81 RAB9A (0.49) POLBNPC1RAB9AMAPTSMN1; SMN2
SCHEMBL11493699 0.79 KDM4E (0.50) KDM4EPOLBAPEX1RECQLTSHR
SCHEMBL25370326 0.78 CA2 (0.50) KDM4EPOLBNPC1RAB9AMAPT
SCHEMBL31238895 0.78 CA2 (0.50) KDM4EPOLBNPC1RAB9AMAPT
SCHEMBL1546125 0.78 KDM4E (0.51) KDM4EPOLBAPEX1RECQLNPC1
SCHEMBL13341117 0.78 PTGS1 (0.43) POLBNPC1RAB9AMAPTSMN1; SMN2

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
US-5439909-A 2-Substituted with amide or thioamide group; antioxidant for lipoproteins, antilipemic agents, anticholesterol agents ADIR ET COMPAGNIE (FR) 1995-08-08 US disclosed
US-5420132-A Antilipemic agents ADIR ET COMPAGNIE (FR) 1995-05-30 US disclosed
EP-0624582-A1 Substituted benzodioxine, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1994-11-17 EP disclosed