SCHEMBL9318921

SCHEMBL9318921

O=C(/C=C/c1ccc(O)c(O)c1)c1cccc(O)c1O

nearest known ligand 0.82

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TERT O14746 2/20 0.82
MAPT P10636 3/20 0.77
PTGS1 P23219 2/20 0.77
PTGS2 P35354 2/20 0.77
KMT2A Q03164 2/20 0.77
KDM4E B2RXH2 1/20 0.77
GAA P10253 1/20 0.77
MAPK1 P28482 1/20 0.77
NPSR1 Q6W5P4 1/20 0.77
MYOC Q99972 1/20 0.77
MEN1 O00255 1/20 0.66
EGFR P00533 1/20 0.66
SRC P12931 1/20 0.66
AKR1B1 P15121 1/20 0.66
NFKB1 P19838 1/20 0.66
CDK2 P24941 1/20 0.66
HSD17B2 P37059 1/20 0.66
PIK3CA P42336 1/20 0.66
NFKB2 Q00653 1/20 0.66
RELA Q04206 1/20 0.66

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
SCHEMBL9318926 1.00 TERT (0.82) TERTMAPTPTGS1PTGS2KMT2A
SCHEMBL31682981 0.90 TERT (1.00) TERTMAPTPTGS1PTGS2KMT2A
SCHEMBL29379310 0.90 TERT (1.00) TERTMAPTPTGS1PTGS2KMT2A
SCHEMBL34958 0.90 TERT (1.00) TERTMAPTPTGS1PTGS2KMT2A
SCHEMBL34959 0.90 TERT (1.00) TERTMAPTPTGS1PTGS2KMT2A
SCHEMBL25192703 0.87 MAPT (1.00) TERTMAPTPTGS1PTGS2KMT2A
SCHEMBL4973168 0.87 MAPT (1.00) TERTMAPTPTGS1PTGS2KMT2A
SCHEMBL31233153 0.87 MAPT (1.00) TERTMAPTPTGS1PTGS2KMT2A
SCHEMBL5508056 0.87 MAPT (1.00) TERTMAPTPTGS1PTGS2KMT2A
SCHEMBL5574069 0.84 MAPT (0.76) TERTMAPTKMT2AKDM4EMAPK1

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
WO-2019195430-A1 STREPTOCOCCUS MUTANS GLUCOSYL TRANSFERASE INHIBITORS FOR DENTAL CARIES THERAPY UAB RESEARCH FOUNDATION (US) 2019-10-10 WO disclosed
EP-0629602-A1 3,4-Dihydroxychalcone derivatives NIPPON HYPOX LABORATORIES INCORPORATED (JP) 1994-12-21 EP disclosed
US-5276058-A Antiinflammatory agents NIPPON HYPOX LABORATORIES INCORPORATED (JP) 1994-01-04 US disclosed