SCHEMBL1114965

SCHEMBL1114965

CC(CC(=O)O)NC(=O)c1ccccc1O

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.62
HPGD P15428 7/20 0.62
ALDH1A1 P00352 7/20 0.62
LMNA P02545 5/20 0.62
HSD17B10 Q99714 5/20 0.62
TSHR P16473 2/20 0.57
MEN1 O00255 4/20 0.51
KMT2A Q03164 4/20 0.51
HTT P42858 4/20 0.49
TP53 P04637 2/20 0.49
GAA P10253 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
MPO P05164 1/20 0.49
HIF1A Q16665 1/20 0.49
POLB P06746 1/20 0.47
NPC1 O15118 3/20 0.45
MAPT P10636 3/20 0.44
NAAA Q02083 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
NLRP1 Q9C000 1/20 0.44

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
SCHEMBL12855956 0.87 KDM4E (0.58) KDM4EHPGDALDH1A1LMNAHSD17B10
SCHEMBL8980562 0.83 LMNA (0.61) KDM4EHPGDALDH1A1LMNAHSD17B10
SCHEMBL1823896 0.82 KDM4E (0.59) KDM4EHPGDALDH1A1LMNAHSD17B10
SCHEMBL7673771 0.81 KMT2A (0.49) KDM4EHPGDALDH1A1HSD17B10MEN1
SCHEMBL1115007 0.81 ALDH1A1 (0.53) KDM4EHPGDALDH1A1LMNAHSD17B10
SCHEMBL12679754 0.81 ALOX5 (0.48) KDM4EHPGDALDH1A1LMNAHSD17B10
SCHEMBL1819327 0.81 KDM4E (0.59) KDM4EHPGDALDH1A1LMNAHSD17B10
SCHEMBL31666111 0.81 KDM4E (0.54) KDM4EHPGDALDH1A1LMNAHSD17B10
SCHEMBL11016850 0.81 ALDH1A1 (0.58) KDM4EHPGDALDH1A1LMNAHSD17B10
SCHEMBL18277717 0.81 KDM4E (0.54) KDM4EHPGDALDH1A1LMNAHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2279732-A2 Compounds and compositions for delivering active agents Emisphere Technologies, Inc. (US) 2011-02-02 EP claimed
CN-1964939-B Compounds and compositions for delivering active agents EMISPHERE TECH INC 2012-11-28 CN disclosed
US-8273794-B2 7-[isopropyl(phenyl)amino]-7-oxoheptanoic acid, 3-(2-Hydroxy-benzoylamino)-butyric acid, 4-Oxo-4-phenyl-butyric acid, 10-(2-Hydroxy-phenyl)-10-oxo-decanoic acid, 4-(4-Methoxy-phenyl)-4-oxo-butyric acid: promoting the absorption of the active agent EMISPHERE TECHNOLOGIES, INC. (US) 2012-09-25 US disclosed
US-8273794-B2 7-[isopropyl(phenyl)amino]-7-oxoheptanoic acid, 3-(2-Hydroxy-benzoylamino)-butyric acid, 4-Oxo-4-phenyl-butyric acid, 10-(2-Hydroxy-phenyl)-10-oxo-decanoic acid, 4-(4-Methoxy-phenyl)-4-oxo-butyric acid: promoting the absorption of the active agent EMISPHERE TECHNOLOGIES, INC. (US) 2012-09-25 US disclosed
EP-2279732-A2 Compounds and compositions for delivering active agents Emisphere Technologies, Inc. (US) 2011-02-02 EP disclosed
EP-2279732-A2 Compounds and compositions for delivering active agents Emisphere Technologies, Inc. (US) 2011-02-02 EP disclosed
US-20080255250-A1 Compounds and Compositions for Delivering Active Agents EMISPHERE TECHNOLOGIES, INC. (US) 2008-10-16 US disclosed
US-20080255250-A1 Compounds and Compositions for Delivering Active Agents EMISPHERE TECHNOLOGIES, INC. (US) 2008-10-16 US disclosed
CN-1964939-A Compounds and compositions for delivering active agents EMISPHERE TECH INC (US) 2007-05-16 CN disclosed
EP-1756039-A4 COMPOUNDS AND COMPOSITIONS FOR DELIVERING ACTIVE AGENTS EMISPHERE TECH INC (US) 2007-05-02 EP disclosed
EP-1756039-A2 COMPOUNDS AND COMPOSITIONS FOR DELIVERING ACTIVE AGENTS Emisphere Technologies, Inc. (US) 2007-02-28 EP disclosed
WO-2005112633-A2 COMPOUNDS AND COMPOSITIONS FOR DELIVERING ACTIVE AGENTS EMISPHERE TECHNOLOGIES, INC. (US) 2005-12-01 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 (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-20080255250-A1 Compounds and Compositions for Delivering Active Agents SERPINB1, ELANE, MMP8 KDM4E 4605/4885HPGD 861/4885ALDH1A1 2208/4885

“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.