SCHEMBL5861799

SCHEMBL5861799

CCOC(=O)/C=C/c1ccc(CO)cc1C

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 3/20 0.56
TTR P02766 1/20 0.48
DPP4 P27487 1/20 0.48
CA12 O43570 1/20 0.48
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
CA7 P43166 1/20 0.48
CA9 Q16790 1/20 0.48
CA14 Q9ULX7 1/20 0.48
CYP3A4 P08684 2/20 0.46
MAOB P27338 1/20 0.44
EGFR P00533 1/20 0.43
AKR1B10 O60218 2/20 0.42
AKR1B1 P15121 2/20 0.42
PTGS2 P35354 1/20 0.42
FDPS P14324 1/20 0.42
P2RY12 Q9H244 1/20 0.41
CCNC P24863 1/20 0.41
CDK8 P49336 1/20 0.41
HSD17B1 P14061 1/20 0.41

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
SCHEMBL5860647 0.87 ESR1 (0.55) ESR1TTRDPP4CA12CA1
SCHEMBL3916081 0.87 ALDH1A1 (0.48) ESR1TTRCA12CA1CA2
SCHEMBL3916083 0.87 ALDH1A1 (0.48) ESR1TTRCA12CA1CA2
SCHEMBL13311783 0.86 CYP3A4 (0.47) ESR1TTRDPP4CA12CA1
SCHEMBL3503009 0.86 CYP3A4 (0.47) ESR1TTRDPP4CA12CA1
SCHEMBL24844752 0.86 TTR (0.46) ESR1TTRDPP4CA12CA1
SCHEMBL17748390 0.83 ESR1 (0.52) ESR1TTRDPP4CA12CA1
SCHEMBL17748391 0.83 ESR1 (0.52) ESR1TTRDPP4CA12CA1
SCHEMBL14848989 0.83 ESR1 (0.52) ESR1TTRDPP4CYP3A4MAOB
SCHEMBL28594638 0.83 ESR1 (0.60) ESR1TTRDPP4CA12CA1

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-2023274257-A1 IMIDAZOLE COMPOUND, AND INTERMEDIATE AND APPLICATION THEREOF 诸葛国琴 2023-01-05 WO disclosed
US-7091237-B2 Furan and thiophene derivatives that activate human peroxisome proliferator activated receptors SMITHKLINE BEECHAM CORPORATION (US) 2006-08-15 US disclosed
US-20040157890-A1 Furan and thiophene derivatives that activate human peroxisome profilerator activated receptors GLAXO GROUP LIMITED (GB) 2004-08-12 US 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-20040157890-A1 Furan and thiophene derivatives that activate human peroxisome profilerator activated receptors PPARG, PPARD, PPARA ESR1 302/4885TTR 1222/4885DPP4 1113/4885

“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.