SCHEMBL8519994

SCHEMBL8519994

Oc1ccc(Cc2ccc(O)cc2)cc1.Oc1ccc(Cc2ccccc2)c(O)c1.Oc1ccccc1Cc1ccccc1O

nearest known ligand 0.77

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.77
KEAP1 Q14145 1/20 0.71
MEN1 O00255 2/20 0.58
KMT2A Q03164 2/20 0.58
MAPT P10636 1/20 0.58
HSPA5 P11021 1/20 0.52
BCL2 P10415 1/20 0.50
BCL2L1 Q07817 1/20 0.50
IDH1 O75874 1/20 0.47
CYP3A4 P08684 1/20 0.46
HPGD P15428 1/20 0.46
ALOX15 P16050 1/20 0.46
HIF1A Q16665 1/20 0.46
HSD17B10 Q99714 1/20 0.46
ESR1 P03372 1/20 0.45
ESR2 Q92731 1/20 0.45
TYR P14679 1/20 0.44

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
SCHEMBL16242571 0.90 KEAP1 (0.88) ALOX5KEAP1MEN1KMT2AMAPT
SCHEMBL68292 0.88 ALOX5 (1.00) ALOX5KEAP1MEN1KMT2AMAPT
SCHEMBL29655583 0.88 ALOX5 (1.00) ALOX5KEAP1MEN1KMT2AMAPT
SCHEMBL29655585 0.88 ALOX5 (1.00) ALOX5KEAP1MEN1KMT2AMAPT
SCHEMBL920838 0.86 KEAP1 (0.96) ALOX5KEAP1MEN1KMT2AMAPT
SCHEMBL29506902 0.84 KEAP1 (1.00) ALOX5KEAP1MEN1KMT2AMAPT
SCHEMBL278523 0.84 MAPT (0.78) ALOX5KEAP1MEN1KMT2AMAPT
SCHEMBL68653 0.84 KEAP1 (1.00) ALOX5KEAP1MEN1KMT2AMAPT
SCHEMBL6292352 0.84 ALOX5 (0.72) ALOX5KEAP1MEN1KMT2AMAPT
SCHEMBL11988719 0.84 ALOX5 (0.62) ALOX5KEAP1MEN1KMT2AMAPT

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0934323-A1 SOLUBLE MONO-ALKYL STANNOIC ACID CATALYST AND ITS USE IN PREPARING HIGH MOLECULAR WEIGHT POLYESTERS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1999-08-11 EP disclosed
WO-1998015559-A1 SOLUBLE MONO-ALKYL STANNOIC ACID CATALYST AND ITS USE IN PREPARING HIGH MOLECULAR WEIGHT POLYESTERS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1998-04-16 WO disclosed