SCHEMBL1004594

SCHEMBL1004594

COC(=O)c1cc(CCC(=O)OC(C)(C)C)c[nH]1

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
BAZ2B Q9UIF8 1/20 0.44
BAZ2A Q9UIF9 1/20 0.44
ALDH1A1 P00352 4/20 0.42
GAA P10253 2/20 0.42
LMNA P02545 1/20 0.42
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
DAO P14920 2/20 0.35
STING1 Q86WV6 1/20 0.34
MAPT P10636 1/20 0.34

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
SCHEMBL1004268 0.81 ALDH1A1 (0.50) BAZ2BBAZ2AALDH1A1GAALMNA
SCHEMBL4699942 0.78 L3MBTL1 (0.45) BAZ2BBAZ2AALDH1A1GAALMNA
SCHEMBL9908199 0.77 BAZ2B (0.57) BAZ2BBAZ2AALDH1A1GAALMNA
SCHEMBL4544349 0.75 BAZ2B (0.62) BAZ2BBAZ2AALDH1A1GAALMNA
SCHEMBL16364739 0.74 BAZ2B (0.56) BAZ2BBAZ2AALDH1A1GAALMNA
SCHEMBL12680354 0.74 CYP4A11 (0.55) ALDH1A1MAPT
SCHEMBL1149734 0.74 ALDH1A1 (0.63) BAZ2BBAZ2AALDH1A1GAAMEN1
SCHEMBL9285452 0.74 BAZ2B (0.53) BAZ2BBAZ2AALDH1A1GAALMNA
SCHEMBL1003459 0.73 GAA (0.42) ALDH1A1GAALMNASTING1
SCHEMBL9147935 0.72 BAZ2B (0.51) BAZ2BBAZ2AALDH1A1GAAMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7902252-B2 Inhibitors of D-amino acid oxidase SEPRACOR, INC. (US) 2011-03-08 US disclosed
US-7902252-B2 Inhibitors of D-amino acid oxidase SEPRACOR, INC. (US) 2011-03-08 US disclosed
US-7902252-B2 Inhibitors of D-amino acid oxidase SEPRACOR, INC. (US) 2011-03-08 US disclosed
WO-2011011330-A2 INHIBITORS OF D-AMINO ACID OXIDASE SEPRACOR INC. (US) 2011-01-27 WO disclosed
WO-2011011330-A2 INHIBITORS OF D-AMINO ACID OXIDASE SEPRACOR INC. (US) 2011-01-27 WO disclosed
US-20100029737-A1 INHIBITORS OF D-AMINO ACID OXIDASE SEPRACOR INC. (US) 2010-02-04 US disclosed
US-20100029737-A1 INHIBITORS OF D-AMINO ACID OXIDASE SEPRACOR INC. (US) 2010-02-04 US disclosed
US-20100029737-A1 INHIBITORS OF D-AMINO ACID OXIDASE SEPRACOR INC. (US) 2010-02-04 US disclosed
EP-2074092-A2 INHIBITORS OF D-AMINO ACID OXIDASE Sepracor Inc. (US) 2009-07-01 EP disclosed
US-20090099248-A1 INHIBITORS OF D-AMINO ACID OXIDASE SEPRACOR INC. (US) 2009-04-16 US disclosed
WO-2008089453-A2 INHIBITORS OF D-AMINO ACID OXIDASE SEPRACOR INC. (US) 2008-07-24 WO 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-20090099248-A1 INHIBITORS OF D-AMINO ACID OXIDASE DDO, DAO, ACHE BAZ2B 3409/4885BAZ2A 3865/4885ALDH1A1 465/4885
US-20100029737-A1 INHIBITORS OF D-AMINO ACID OXIDASE DDO, DAO, ACHE BAZ2B 3409/4885BAZ2A 3865/4885ALDH1A1 465/4885

“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.