SCHEMBL1005267

SCHEMBL1005267

COC(=O)c1ccc(CCC(=O)O)[nH]1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 3/20 0.49
CYP1A2 P05177 2/20 0.49
CYP2C9 P11712 1/20 0.49
KDM4E B2RXH2 3/20 0.47
GAA P10253 3/20 0.47
GLA P06280 2/20 0.47
MMP2 P08253 1/20 0.41
POLB P06746 3/20 0.41
ALDH1A1 P00352 2/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
RCE1 Q9Y256 1/20 0.37
FFAR4 Q5NUL3 1/20 0.36
FFAR1 O14842 2/20 0.36
TSHR P16473 1/20 0.36
KEAP1 Q14145 1/20 0.36
HPGD P15428 1/20 0.36
GPR17 Q13304 1/20 0.36

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
SCHEMBL10503868 0.84 HSD17B10 (0.46) HSD17B10CYP1A2CYP2C9KDM4EGAA
SCHEMBL7367241 0.81 GAA (0.51) CYP1A2KDM4EGAAGLAMMP2
SCHEMBL8236144 0.79 GAA (0.53) CYP1A2KDM4EGAAGLAMMP2
SCHEMBL28618725 0.79 GAA (0.53) CYP1A2KDM4EGAAGLAMMP2
SCHEMBL28637393 0.77 HSD17B10 (0.41) HSD17B10CYP1A2CYP2C9KDM4EALDH1A1
SCHEMBL28618722 0.76 KDM4E (0.50) HSD17B10CYP1A2KDM4EGAAGLA
SCHEMBL70624 0.75 GAA (0.67) HSD17B10CYP1A2KDM4EGAAGLA
SCHEMBL13141200 0.75 GAA (0.49) HSD17B10CYP1A2KDM4EGAAGLA
SCHEMBL6178828 0.73 KDM4E (0.47) HSD17B10CYP1A2KDM4EGAAGLA
SCHEMBL6902078 0.73 GAA (0.55) CYP1A2KDM4EGAAGLAMMP2

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 7 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
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
CN-101636384-A The inhibitor of D-amino-acid oxidase SEPRACOR INC 2010-01-27 CN 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 HSD17B10 1605/4885CYP1A2 2041/4885CYP2C9 2411/4885
US-20100029737-A1 INHIBITORS OF D-AMINO ACID OXIDASE DDO, DAO, ACHE HSD17B10 1605/4885CYP1A2 2041/4885CYP2C9 2411/4885

“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.