SCHEMBL13744712

SCHEMBL13744712

COc1cc(OCc2ccccc2)c2c(ccc3cc(OC)cc(OCc4ccccc4)c32)c1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 1/20 0.54
▸ ALOX5 P09917 1/20 0.53
▸ ABCB1 P08183 5/20 0.51
▸ HTR1A P08908 1/20 0.50
▸ DRD2 P14416 1/20 0.50
▸ PDGFRB P09619 1/20 0.50
▸ PDGFRA P16234 1/20 0.50
▸ HDAC8 Q9BY41 1/20 0.49
▸ PPARG P37231 1/20 0.46
▸ MAPT P10636 1/20 0.46
▸ MAPK1 P28482 1/20 0.46
▸ TDP1 Q9NUW8 1/20 0.46
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ PIN1 Q13526 1/20 0.45

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
SCHEMBL29409810 0.87 ALOX5 (0.55) MAOBALOX5ABCB1HTR1ADRD2
SCHEMBL4077230 0.84 MTNR1A (0.47) MAOBALOX5ABCB1HTR1APDGFRB
SCHEMBL27489226 0.83 MAOB (0.53) MAOBALOX5ABCB1HTR1ADRD2
SCHEMBL28108815 0.81 MAOB (0.59) MAOBABCB1HTR1ADRD2HDAC8
SCHEMBL7345409 0.80 MAOB (0.51) MAOBALOX5ABCB1HTR1ADRD2
SCHEMBL7827220 0.79 PDGFRB (0.59) MAOBALOX5ABCB1HTR1ADRD2
SCHEMBL19267891 0.79 ABCB1 (0.58) MAOBABCB1HTR1ADRD2PPARG
SCHEMBL21957670 0.77 MAOB (0.54) MAOBABCB1HTR1ADRD2HDAC8
SCHEMBL23906959 0.77 MAOB (0.79) MAOBALOX5ABCB1MAPTMAPK1
SCHEMBL21582171 0.77 ALOX5 (0.56) MAOBALOX5PDGFRBPDGFRAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090215908-A1 TOLL LIKE RECEPTOR (TLR) SIGNALING ANTAGONIST RELIANCE LIFE SCIENCES PVT. LTD. (IN) 2009-08-27 — — 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-20090215908-A1 TOLL LIKE RECEPTOR (TLR) SIGNALING ANTAGONIST TLR4, TLR5, TLR1 MAOB 3382/4885ALOX5 275/4885ABCB1 3233/4885

“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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