SCHEMBL12864271

SCHEMBL12864271

CCC(=O)Cc1ccc(C(=O)OC(OC(=O)c2cc3occc3[nH]2)C(C)C)cc1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ DAO P14920 2/20 0.41
▸ KDM4E B2RXH2 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ TP53 P04637 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ GAA P10253 1/20 0.32
▸ POLB P06746 1/20 0.32
▸ CYP4F2 P78329 1/20 0.32
▸ CYP4A11 Q02928 1/20 0.32
▸ HRH3 Q9Y5N1 1/20 0.31
▸ MMP2 P08253 1/20 0.30
▸ MMP13 P45452 1/20 0.30
▸ NPC1 O15118 1/20 0.30
▸ RAB9A P51151 1/20 0.30
▸ NTRK1 P04629 1/20 0.30

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
SCHEMBL12864263 0.92 DAO (0.42) DAOKDM4ELMNATP53L3MBTL1
SCHEMBL12903493 0.91 DAO (0.40) DAOKDM4ELMNATP53L3MBTL1
SCHEMBL12864272 0.89 DAO (0.41) DAOKDM4ELMNATP53L3MBTL1
SCHEMBL12864274 0.84 DAO (0.56) DAOKDM4ELMNATP53L3MBTL1
SCHEMBL12864261 0.83 DAO (0.44) DAOKDM4ELMNAL3MBTL1GAA
SCHEMBL12864262 0.83 DAO (0.51) DAOKDM4ELMNATP53L3MBTL1
SCHEMBL1170866 0.83 DAO (0.48) DAOKDM4ELMNATP53L3MBTL1
SCHEMBL12903501 0.83 DAO (0.41) DAOKDM4ELMNATP53L3MBTL1
SCHEMBL12903504 0.81 DAO (0.40) DAOKDM4ELMNATP53L3MBTL1
SCHEMBL1170875 0.79 DAO (0.51) DAOKDM4ELMNATP53L3MBTL1

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-20110034434-A1 PRODRUGS OF FUSED HETEROCYCLIC INHIBITORS OF D-AMINO ACID OXIDASE SEPRACOR INC. (US) 2011-02-10 — — US disclosed
US-20100120740-A1 PRODRUGS OF FUSED HETEROCYCLIC INHIBITORS OF D-AMINO ACID OXIDASE SEPRACOR INC. (US) 2010-05-13 — — 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 (2 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-20100120740-A1 PRODRUGS OF FUSED HETEROCYCLIC INHIBITORS OF D-AMINO ACID OXIDASE DDO, DAO, AOC1 DAO 2/4885KDM4E 2574/4885LMNA 4705/4885
US-20110034434-A1 PRODRUGS OF FUSED HETEROCYCLIC INHIBITORS OF D-AMINO ACID OXIDASE DDO, DAO, AOC1 DAO 2/4885KDM4E 2574/4885LMNA 4705/4885

“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