SCHEMBL15034465

SCHEMBL15034465

O=C1C[C@H](O)C[C@@H](CCOc2ccc3c(c2)OCO3)O1

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 6/20 0.48
▸ MAOA P21397 2/20 0.45
▸ TSHR P16473 2/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ HPGD P15428 1/20 0.42
▸ LMNA P02545 1/20 0.42
▸ TP53 P04637 1/20 0.42
▸ POLB P06746 1/20 0.42
▸ FKBP1A P62942 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
SCHEMBL15034448 0.77 MEN1 (0.38) ALDH1A1POLB
SCHEMBL107322 0.72 MAOB (0.83) MAOBMAOATSHRALDH1A1FKBP1A
SCHEMBL15034472 0.71 — —
SCHEMBL108114 0.71 MAOB (0.74) MAOBMAOATSHRALDH1A1FKBP1A
SCHEMBL7345416 0.70 MAOB (0.68) MAOBMAOATSHRPOLBFKBP1A
SCHEMBL5346825 0.70 MAOB (0.71) MAOBMAOATSHRALDH1A1FKBP1A
SCHEMBL4321060 0.70 MAOB (0.68) MAOBMAOATSHRPOLBFKBP1A
SCHEMBL984460 0.70 MAOB (0.68) MAOBMAOATSHR
SCHEMBL11802724 0.70 MAOB (0.72) MAOBMAOATSHRALDH1A1FKBP1A
SCHEMBL18947944 0.69 — —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130157986-A1 NOVEL METHYLENEDIOXY PHENOLIC COMPOUNDS AND THEIR USE TO TREAT DISEASE INVASC THERAPEUTICS, INC. (US) 2013-06-20 — — US disclosed
US-20130157986-A1 NOVEL METHYLENEDIOXY PHENOLIC COMPOUNDS AND THEIR USE TO TREAT DISEASE INVASC THERAPEUTICS, INC. (US) 2013-06-20 — — 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-20130157986-A1 NOVEL METHYLENEDIOXY PHENOLIC COMPOUNDS AND THEIR USE TO TREAT DISEASE REN, PCSK9, COMT MAOB 477/4885MAOA 1160/4885TSHR 4563/4885

“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.

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