SCHEMBL134197

SCHEMBL134197

O=c1c2ccccc2oc2c3c(ccc12)OC(c1ccccc1)(c1ccccc1)O3

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTGS2 P35354 1/20 0.48
▸ MAOA P21397 10/20 0.47
▸ KDM4E B2RXH2 4/20 0.46
▸ ALDH1A1 P00352 3/20 0.46
▸ GLA P06280 1/20 0.46
▸ CYP3A4 P08684 1/20 0.46
▸ MAPT P10636 1/20 0.46
▸ HPGD P15428 1/20 0.46
▸ PGAM1 P18669 1/20 0.46
▸ CASP1 P29466 1/20 0.46
▸ CASP7 P55210 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ HSD17B10 Q99714 1/20 0.46
▸ NPC1 O15118 3/20 0.43
▸ RAB9A P51151 3/20 0.43
▸ LMNA P02545 1/20 0.43
▸ TTR P02766 4/20 0.40
▸ KDM5A P29375 1/20 0.39
▸ POLB P06746 1/20 0.37
▸ L3MBTL1 Q9Y468 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
SCHEMBL149614 0.83 MAOA (0.55) PTGS2MAOAKDM4EALDH1A1CYP3A4
SCHEMBL13298866 0.74 PTGS2 (0.44) PTGS2MAOAKDM4EALDH1A1GLA
SCHEMBL30865750 0.71 MEN1 (0.38) MAOAALDH1A1HPGDLMNA
Xanthone SCHEMBL28434710 0.69 MAOA (0.95) MAOAKDM4EALDH1A1GLACYP3A4
SCHEMBL32667434 0.69 SMN1; SMN2 (0.45) KDM4EALDH1A1CYP3A4MAPTHPGD
SCHEMBL12764548 0.67 MAOA (0.61) PTGS2MAOAKDM4EALDH1A1GLA
SCHEMBL30674066 0.67 MAOA (0.67) PTGS2MAOAKDM4EALDH1A1GLA
SCHEMBL12608738 0.67 MAOA (0.67) PTGS2MAOAKDM4EALDH1A1GLA
Xanthone SCHEMBL41161 0.67 MAOA (1.00) PTGS2MAOAKDM4EALDH1A1GLA
Xanthone SCHEMBL29358061 0.67 MAOA (1.00) PTGS2MAOAKDM4EALDH1A1GLA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8501803-B2 Garcinia derivative, its preparing method and medicinal use CHINA PHARMACEUTICAL UNIVERSITY (CN) 2013-08-06 — — US disclosed
US-8501803-B2 Garcinia derivative, its preparing method and medicinal use CHINA PHARMACEUTICAL UNIVERSITY (CN) 2013-08-06 — — US disclosed
EP-2494971-A1 GAMBOGIC ACID DERIVATIVES, PREPARATIVE METHODS AND USES THEREOF China Pharmaceutical University (CN) 2012-09-05 — — EP disclosed
US-20120059050-A1 GARCINIA DERIVATIVE, ITS PREPARING METHOD AND MEDICINAL USE CHINA PHARMACEUTICAL UNIVERSITY (CN) 2012-03-08 — — US disclosed
US-20120059050-A1 GARCINIA DERIVATIVE, ITS PREPARING METHOD AND MEDICINAL USE CHINA PHARMACEUTICAL UNIVERSITY (CN) 2012-03-08 — — 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-20120059050-A1 GARCINIA DERIVATIVE, ITS PREPARING METHOD AND MEDICINAL USE GLG1, GDI1, GYPA PTGS2 91/4885MAOA 2460/4885KDM4E 834/4885

“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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