SCHEMBL6589075

SCHEMBL6589075

COc1ccc2oc(-c3oc(=O)c(C)c(O)c3C)cc2c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.50
ALDH1A1 P00352 4/20 0.50
HPGD P15428 3/20 0.50
CA12 O43570 2/20 0.50
CA1 P00915 2/20 0.50
CA2 P00918 2/20 0.50
CA9 Q16790 2/20 0.50
CA3 P07451 1/20 0.50
CA6 P23280 1/20 0.50
CA5A P35218 1/20 0.50
CA7 P43166 1/20 0.50
CA14 Q9ULX7 1/20 0.50
CA5B Q9Y2D0 1/20 0.50
MAOB P27338 4/20 0.48
APP P05067 4/20 0.48
GAA P10253 1/20 0.47
CYP2A6 P11509 1/20 0.47
PTGES O14684 1/20 0.46
NPC1 O15118 1/20 0.44
MAPT P10636 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
SCHEMBL6592345 0.90 ALDH1A1 (0.50) KDM4EALDH1A1HPGDCA12CA1
SCHEMBL6591754 0.88 KDM4E (0.42) KDM4EALDH1A1HPGDCA12CA1
SCHEMBL6593950 0.88 NPC1 (0.48) MAOBAPPPTGESNPC1RAB9A
SCHEMBL6588457 0.87 MAOB (0.58) MAOBAPPNPC1RAB9A
SCHEMBL6593518 0.84 ESR1 (0.50) KDM4EALDH1A1HPGDCA12CA1
SCHEMBL6596118 0.83 MAOB (0.40) KDM4EALDH1A1HPGDCA12CA1
SCHEMBL6594054 0.83 KDM4E (0.36) KDM4EALDH1A1HPGDCA12CA1
SCHEMBL6592310 0.83 CA12 (0.52) KDM4EALDH1A1CA12CA1CA9
SCHEMBL6591035 0.83 MAOB (0.44) MAOB
SCHEMBL6596608 0.83 ACHE (0.42) MAOBNPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1063235-B1 BENZOFURYLPYRONE DERIVATIVES TEIJIN LTD (JP) 2004-05-12 EP disclosed
US-20030186976-A1 Benzofurylpyrone derivatives TEIJIN LIMITED, MICROBIAL CHEMISTRY RESEARCH FOUNDATION 2003-10-02 US disclosed
US-6589984-B1 Blood cholesterol and triglycerides (TG) themselves are generally insoluble in blood, and they exist as lipoproteins by binding with apolipoproteins. In the body, triglycerides are biosynthesized primarily in the liver from acetyl CoA as TEIJIN LIMITED (JP) 2003-07-08 US disclosed
EP-1063235-A1 BENZOFURYLPYRONE DERIVATIVES TEIJIN LIMITED (JP) 2000-12-27 EP 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-20030186976-A1 Benzofurylpyrone derivatives PLIN5, ACSL5, PLIN1 KDM4E 1274/4885ALDH1A1 1272/4885HPGD 926/4885

“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.