SCHEMBL6595986

SCHEMBL6595986

Cc1c(-c2cc3ccc(OCC4CCCCN4C)cc3o2)oc(=O)c(C)c1O

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CHRNB4 P30926 5/20 0.47
CHRNA3 P32297 5/20 0.47
CHRNB2 P17787 3/20 0.47
CHRNB1 P11230 2/20 0.47
CHRNB3 Q05901 2/20 0.47
CHRNA4 P43681 2/20 0.44
MAOB P27338 4/20 0.42
MAOA P21397 3/20 0.42
KCNH2 Q12809 1/20 0.41
MCHR1 Q99705 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
SCHEMBL6592642 0.93 CHRNB4 (0.45) CHRNB4CHRNA3CHRNB2CHRNB1CHRNB3
SCHEMBL6595192 0.86 MAOB (0.47) MAOBMAOA
SCHEMBL6593626 0.85 MAOB (0.46) MAOBMAOA
SCHEMBL6591005 0.84 MAOB (0.63) MAOBMAOA
SCHEMBL6597903 0.84 MAOB (0.48) MAOBMAOA
SCHEMBL6596054 0.82 MAOB (0.56) MAOBMAOA
SCHEMBL6593633 0.80 MAOB (0.40) MAOBMAOA
SCHEMBL6597849 0.79 MAOB (0.39) MAOBMAOA
SCHEMBL6596275 0.79 MAOB (0.42) MAOBMAOA
SCHEMBL6591063 0.79 GPR119 (0.43)

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 CHRNB4 3949/4885CHRNA3 4027/4885CHRNB2 4313/4885

“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.