SCHEMBL514058

SCHEMBL514058

O=C(O)/C=C/c1cc(O)c(O)c(O)c1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.64
CA1 P00915 5/20 0.64
CA2 P00918 5/20 0.64
CA4 P22748 5/20 0.64
HSD17B10 Q99714 4/20 0.64
CA12 O43570 4/20 0.64
CA3 P07451 4/20 0.64
CA6 P23280 4/20 0.64
CA5A P35218 4/20 0.64
CA7 P43166 4/20 0.64
CA9 Q16790 4/20 0.64
CA14 Q9ULX7 4/20 0.64
CA5B Q9Y2D0 4/20 0.64
AKR1B10 O60218 3/20 0.64
AKR1B1 P15121 3/20 0.64
DPP4 P27487 3/20 0.64
CYP3A4 P08684 3/20 0.64
ALDH1A1 P00352 3/20 0.64
HPGD P15428 3/20 0.64
HDAC3 O15379 2/20 0.64

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
SCHEMBL514059 1.00 KDM4E (0.64) KDM4ECA1CA2CA4HSD17B10
SCHEMBL20886496 0.90 KDM4E (0.58) KDM4ECA1CA2CA4HSD17B10
SCHEMBL29921586 0.90 KDM4E (0.58) KDM4ECA1CA2CA4HSD17B10
SCHEMBL22991430 0.86 CYP3A4 (0.61) KDM4ECA1CA2CA4HSD17B10
SCHEMBL22991432 0.86 KDM4E (0.55) KDM4ECA1CA2CA4HSD17B10
SCHEMBL28392399 0.86 AKR1C3 (0.69) KDM4ECA1CA2CA4HSD17B10
SCHEMBL22068236 0.85 ALOX5 (0.57) KDM4ECA1CA2CA4HSD17B10
SCHEMBL10085810 0.83 PKM (0.87) KDM4ECA1CA2CA4HSD17B10
SCHEMBL14351167 0.83 AKR1B10 (0.54) KDM4ECA1CA2CA4HSD17B10
SCHEMBL29537849 0.83 PKM (0.87) KDM4ECA1CA2CA4HSD17B10

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 89 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117481327-B Lemon-flavored liquid essence and preparation method thereof 无锡市锡梅食品科技有限公司 2024-04-12 CN claimed
CN-117481327-A Lemon-flavored liquid essence and preparation method thereof 无锡市锡梅食品科技有限公司 2024-02-02 CN claimed
CN-110894286-B Polyester polyol for solar backboard laminating adhesive and preparation method thereof 湖北荆州华邦化学有限公司 2022-05-13 CN claimed
CN-110894286-A Polyester polyol for solar backboard laminating adhesive and preparation method thereof 湖北荆州华邦化学有限公司 2020-03-20 CN claimed
US-9279093-B2 Lubricating composition containing an aromatic compound THE LUBRIZOL CORPORATION (US) 2016-03-08 US claimed
US-20160002564-A1 LUBRICATING COMPOSITION CONTAINING AN AROMATIC COMPOUND LUBRIZOL CORP (US) 2016-01-07 US claimed
US-7026518-B2 Resveratrol analogs LAILA IMPEX (IN) 2006-04-11 US claimed
US-20040209951-A1 Novel resveratrol analogs LAILA IMPEX (IN) 2004-10-21 US claimed
WO-2004000302-A1 NOVEL RESVERATROL ANALOGS GOKARAJU GANGA RAJU (IN) 2003-12-31 WO claimed
JP-4283501-A None JP disclosed
WO-2024153680-A1 NOVEL CNSL-DERIVED COMPOUNDS, AND APPLICATION THEREOF IN COSMETICS ORPIA INNOVATION (FR) 2024-07-25 WO disclosed
US-12044969-B2 Resist underlayer film-forming composition NISSAN CHEMICAL CORPORATION (JP) 2024-07-23 US disclosed
US-12044969-B2 Resist underlayer film-forming composition NISSAN CHEMICAL CORPORATION (JP) 2024-07-23 US disclosed
US-20240180156-A1 BIOACTIVE COMPOSITION FOR IMPROVING STRESS TOLERANCE OF PLANTS FYTEKO (BE) 2024-06-06 US disclosed
WO-2011084657-A1 LUBRICATING COMPOSITION CONTAINING AN AROMATIC COMPOUND THE LUBRIZOL CORPORATION (US) 2011-07-14 WO disclosed
WO-2010027594-A2 CINNAMIC ACID-BASED OLIGOMERS AND USES THEREOF VIRGINIA COMMONWEALTH UNIVERSITY (US) 2010-03-11 WO disclosed
US-7026518-B2 Resveratrol analogs LAILA IMPEX (IN) 2006-04-11 US disclosed
US-20040209951-A1 Novel resveratrol analogs LAILA IMPEX (IN) 2004-10-21 US disclosed
WO-2004000302-A1 NOVEL RESVERATROL ANALOGS GOKARAJU GANGA RAJU (IN) 2003-12-31 WO disclosed
JP-H04283501-A FRESHNESS PRESERVATIVE OF CUT FLOWER MITSUI PETROCHEM IND LTD 1992-10-08 JP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040209951-A1 Novel resveratrol analogs HRH1, CBR1, CBR3 KDM4E 1415/4885CA1 4818/4885CA2 3227/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.