SCHEMBL3331917

SCHEMBL3331917

Cc1cc2c(c3ccccc13)C(=O)C(O)=CC2=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 7/20 0.41
▸ KDM4E B2RXH2 5/20 0.41
▸ ALDH1A1 P00352 5/20 0.41
▸ HPGD P15428 4/20 0.41
▸ CYP3A4 P08684 3/20 0.41
▸ MAPK1 P28482 3/20 0.41
▸ PTPN22 Q9Y2R2 1/20 0.41
▸ HIF1A Q16665 3/20 0.38
▸ EPAS1 Q99814 2/20 0.38
▸ NQO1 P15559 1/20 0.37
▸ KMT2A Q03164 5/20 0.37
▸ MEN1 O00255 4/20 0.37
▸ BLM P54132 3/20 0.37
▸ CYP1A2 P05177 3/20 0.37
▸ TP53 P04637 3/20 0.37
▸ GAA P10253 3/20 0.37
▸ USP2 O75604 2/20 0.37
▸ ATM Q13315 2/20 0.37
▸ CYP2C19 P33261 2/20 0.37
▸ HSPD1 P10809 2/20 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
SCHEMBL3335457 0.78 IDO1 (0.54) HIF1AEPAS1CDC25ACDC25BIDO1
SCHEMBL9350222 0.73 DNMT1 (0.56) MAPTKDM4EALDH1A1HPGDCYP3A4
SCHEMBL30222271 0.73 DNMT1 (0.56) MAPTKDM4EALDH1A1HPGDCYP3A4
SCHEMBL5806124 0.73 MAPT (0.49) MAPTKDM4EALDH1A1HPGDCYP3A4
SCHEMBL8993580 0.71 XIAP (0.39) MAPTKDM4EALDH1A1HPGDCYP3A4
SCHEMBL30002673 0.71 XIAP (0.39) MAPTKDM4EALDH1A1HPGDCYP3A4
SCHEMBL20364866 0.69 PIM1 (0.59) MAPTKDM4EALDH1A1HPGDCYP3A4
SCHEMBL3331894 0.67 MEN1 (0.40) MAPTKDM4EALDH1A1CYP3A4MAPK1
SCHEMBL31634605 0.67 CYP1A2 (0.44) MAPTKDM4EALDH1A1HPGDCYP3A4
SCHEMBL10578988 0.67 LMNA (0.56) MAPTKDM4EALDH1A1KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2137175-B1 NOVEL PHENANTHRENEQUINONE-BASED COMPOUND AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME FOR THE TREATMENT OR PREVENTION OF DISEASE INVOLVING METABOLIC SYNDROME MAZENCE INC (KR) 2013-09-25 — — EP disclosed
US-8404869-B2 Phenanthrenequinone-based compound and pharmaceutical composition containing the same for the treatment or prevention of disease involving metabolic syndrome MAZENCE INC. (KR) 2013-03-26 — — US disclosed
US-20100137422-A1 NOVEL PHENANTHRENEQUINONE-BASED COMPOUND AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME FOR THE TREATMENT OR PREVENTION OF DISEASE INVOLVING METABOLIC SYNDROME YUNGJIN PHARM. CO., LTD. (KR) 2010-06-03 — — 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-20100137422-A1 NOVEL PHENANTHRENEQUINONE-BASED COMPOUND AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME FOR THE TREATMENT OR PREVENTION OF DISEASE INVOLVING METABOLIC SYNDROME CYP27A1, CYP46A1, PCSK9 MAPT 1685/4885KDM4E 3921/4885ALDH1A1 863/4885

“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.

Send feedback