SCHEMBL6594253

SCHEMBL6594253

CCc1c(-c2cc3cc(OCc4cccnc4)ccc3o2)oc(=O)c(C)c1O

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.43
HPGD P15428 1/20 0.43
ACHE P22303 8/20 0.43
MAOB P27338 8/20 0.41
PRKDC P78527 3/20 0.40
GRM2 Q14416 2/20 0.40
HCAR2 Q8TDS4 1/20 0.39
MAOA P21397 1/20 0.38
BRD4 O60885 1/20 0.38
CREBBP Q92793 1/20 0.38

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
SCHEMBL6588945 0.91 ACHE (0.45) ALDH1A1HPGDACHEMAOBPRKDC
SCHEMBL6595602 0.89 MAOB (0.50) ALDH1A1ACHEMAOBMAOA
SCHEMBL6591994 0.84 ACHE (0.48) ACHEMAOBPRKDCMAOA
SCHEMBL6590245 0.81 ACHE (0.43) ACHEMAOBMAOA
SCHEMBL6597434 0.80 ACHE (0.44) ACHEMAOBMAOA
SCHEMBL6593862 0.80 MAOB (0.44) ACHEMAOBMAOA
SCHEMBL6591398 0.79 MAOB (0.54) ACHEMAOBMAOA
SCHEMBL8068337 0.79 BRD4 (0.42) ALDH1A1HPGDACHEMAOBPRKDC
SCHEMBL6591035 0.76 MAOB (0.44) ACHEMAOBMAOA
SCHEMBL6592901 0.76 MAOB (0.44) ALDH1A1HPGDACHEMAOBMAOA

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 ALDH1A1 1272/4885HPGD 926/4885ACHE 4708/4885

“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.