SCHEMBL1114994

SCHEMBL1114994

CN(C(=O)CCCCCCC(=O)O)c1ccc(Cl)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 1/20 0.45
ALDH1A1 P00352 1/20 0.44
POLB P06746 1/20 0.44
DRD4 P21917 1/20 0.44
MDM2 Q00987 2/20 0.44
LTB4R Q15722 2/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
CHRNB2 P17787 1/20 0.40
CHRNB4 P30926 1/20 0.40
CHRNA3 P32297 1/20 0.40
CHRNA4 P43681 1/20 0.40
RXRA P19793 1/20 0.40
POLQ O75417 1/20 0.40
KYAT1 Q16773 1/20 0.39
HDAC1 Q13547 1/20 0.39
KDM4A O75164 1/20 0.39
KDM4C Q9H3R0 1/20 0.39
LMNA P02545 1/20 0.39
TSHR P16473 1/20 0.39

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
SCHEMBL1115085 1.00 FOLH1 (0.45) FOLH1ALDH1A1POLBDRD4MDM2
SCHEMBL1115013 1.00 FOLH1 (0.45) FOLH1ALDH1A1POLBDRD4MDM2
SCHEMBL1114953 1.00 FOLH1 (0.45) FOLH1ALDH1A1POLBDRD4MDM2
SCHEMBL1114716 0.98 FOLH1 (0.46) FOLH1ALDH1A1POLBDRD4MDM2
SCHEMBL1114895 0.95 ALDH1A1 (0.49) FOLH1ALDH1A1POLBDRD4MDM2
SCHEMBL1114865 0.88 DRD4 (0.50) FOLH1ALDH1A1POLBDRD4MDM2
SCHEMBL12679864 0.88 DRD4 (0.42) FOLH1ALDH1A1POLBDRD4MEN1
SCHEMBL12679928 0.88 DRD4 (0.42) FOLH1ALDH1A1POLBDRD4MEN1
SCHEMBL12679939 0.88 DRD4 (0.42) FOLH1ALDH1A1POLBDRD4MEN1
SCHEMBL12679937 0.87 DRD4 (0.41) FOLH1ALDH1A1POLBDRD4MEN1

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
EP-1756039-B1 Compounds and compositions for delivering active agents EMISPHERE TECH INC (US) 2012-10-17 EP disclosed
EP-1756039-B1 Compounds and compositions for delivering active agents EMISPHERE TECH INC (US) 2012-10-17 EP 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
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

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 FOLH1 215/4885ALDH1A1 2208/4885POLB 985/4885

“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.