SCHEMBL6597444

SCHEMBL6597444

Cc1c(-c2cc3ccc(OCC(C)(C)C)cc3o2)oc(=O)c(C)c1O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.39
NPC1 O15118 3/20 0.39
MAOB P27338 3/20 0.38
ALDH1A1 P00352 4/20 0.38
KDM4E B2RXH2 3/20 0.38
HPGD P15428 3/20 0.38
GLA P06280 3/20 0.38
GAA P10253 2/20 0.38
HSD17B10 Q99714 2/20 0.38
TP53 P04637 1/20 0.38
MAPT P10636 1/20 0.38
MAPK1 P28482 1/20 0.38
CYP1A2 P05177 2/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
PTPN1 P18031 1/20 0.37
ACHE P22303 1/20 0.37
CA12 O43570 1/20 0.37
CA1 P00915 1/20 0.37
CA4 P22748 1/20 0.37

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
SCHEMBL6596118 0.91 MAOB (0.40) RAB9AMAOBALDH1A1KDM4EHPGD
SCHEMBL6591841 0.87 CA9 (0.51) RAB9AMAOBALDH1A1KDM4EHPGD
SCHEMBL6592197 0.85 MAOB (0.39) RAB9ANPC1MAOBALDH1A1KDM4E
SCHEMBL6592345 0.83 ALDH1A1 (0.50) RAB9ANPC1MAOBALDH1A1KDM4E
SCHEMBL6590829 0.83 SLC16A3 (0.45) RAB9ANPC1MAOBALDH1A1KDM4E
SCHEMBL6597032 0.83 MAOB (0.54) MAOBALDH1A1KDM4EGLAGAA
SCHEMBL6595179 0.83 MAOB (0.57) NPC1MAOBACHECA12CA1
SCHEMBL6591831 0.83 MTNR1A (0.44) RAB9AMAOBALDH1A1KDM4EHPGD
SCHEMBL6590537 0.83 MAOB (0.46) RAB9ANPC1MAOBACHECA12
SCHEMBL6597903 0.83 MAOB (0.48) MAOBACHE

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 RAB9A 4399/4885NPC1 512/4885MAOB 3367/4885

“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.