SCHEMBL6198568

SCHEMBL6198568

CC(=O)Oc1[c]cc(OC(C)=O)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.50
MAPT P10636 3/20 0.46
POLB P06746 2/20 0.46
PKM P14618 1/20 0.46
ELANE P08246 1/20 0.44
HSD17B10 Q99714 1/20 0.43
GAA P10253 3/20 0.42
ALDH1A1 P00352 1/20 0.42
HSP90AA1 P07900 1/20 0.42
KDM4E B2RXH2 3/20 0.41
CYP3A4 P08684 2/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
TTR P02766 1/20 0.41
TP53 P04637 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
GLA P06280 2/20 0.40
BACE1 P56817 2/20 0.40
ACHE P22303 1/20 0.40
ESR1 P03372 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
SCHEMBL194076 0.78 LMNA (0.48) LMNAMAPTPOLBPKMELANE
SCHEMBL7723363 0.78 ABCB11 (0.44) LMNAMAPTPOLBPKMELANE
SCHEMBL269329 0.75 LMNA (0.80) LMNAMAPTPOLBPKMELANE
SCHEMBL7405389 0.74 CA1 (0.44) LMNAMAPTPKMHSD17B10GAA
SCHEMBL3147574 0.73 ELANE (0.59) LMNAMAPTELANEALDH1A1MEN1
SCHEMBL14760365 0.73 LMNA (0.76) LMNAMAPTPOLBPKMELANE
Lithium SCHEMBL30522746 0.73 LMNA (0.76) LMNAMAPTPOLBPKMELANE
SCHEMBL1451590 0.71 LMNA (0.47) LMNAMAPTPOLBPKMELANE
SCHEMBL131380 0.69 KDM4E (0.41) LMNAMAPTELANEHSD17B10GAA
SCHEMBL24435576 0.69 LMNA (0.70) LMNAMAPTPOLBPKMELANE

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 24 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2814831-B1 NEW QUATERNARY AMMONIUM SALTS, METHOD FOR PREPARATION AND APPLICATIONS THEREOF UNIV MEDYCZNY IM KAROLA MARCINKOWSKIEGO (PL) 2018-08-01 EP claimed
US-9169267-B2 Quaternary ammonium salts, method for preparation and applications thereof UNIWERSYTET MEDYCZNY IM. KAROLA MARCINKOWSKIEGO (PL) 2015-10-27 US claimed
US-20150080583-A1 QUATERNARY AMMONIUM SALTS, METHOD FOR PREPARATION AND APPLICATIONS THEREOF UNIWERSYTET MEDYCZNY IM. KAROLA MARCINKOWSKIEGO (PL) 2015-03-19 US claimed
EP-2814831-A1 NEW QUATERNARY AMMONIUM SALTS, METHOD FOR PREPARATION AND APPLICATIONS THEREOF Uniwersytet Medyczny Im. Karola Marcinkowskiego (PL) 2014-12-24 EP claimed
WO-2013115661-A1 NEW QUATERNARY AMMONIUM SALTS, METHOD FOR PREPARATION AND APPLICATIONS THEREOF UNIWERSYTET MEDYCZNY IM. KAROLA MARCINKOWSKIEGO (PL) 2013-08-08 WO claimed
EP-2814831-B1 NEW QUATERNARY AMMONIUM SALTS, METHOD FOR PREPARATION AND APPLICATIONS THEREOF UNIV MEDYCZNY IM KAROLA MARCINKOWSKIEGO (PL) 2018-08-01 EP disclosed
US-9169267-B2 Quaternary ammonium salts, method for preparation and applications thereof UNIWERSYTET MEDYCZNY IM. KAROLA MARCINKOWSKIEGO (PL) 2015-10-27 US disclosed
US-20150080583-A1 QUATERNARY AMMONIUM SALTS, METHOD FOR PREPARATION AND APPLICATIONS THEREOF UNIWERSYTET MEDYCZNY IM. KAROLA MARCINKOWSKIEGO (PL) 2015-03-19 US disclosed
EP-2814831-A1 NEW QUATERNARY AMMONIUM SALTS, METHOD FOR PREPARATION AND APPLICATIONS THEREOF Uniwersytet Medyczny Im. Karola Marcinkowskiego (PL) 2014-12-24 EP disclosed
WO-2013115661-A1 NEW QUATERNARY AMMONIUM SALTS, METHOD FOR PREPARATION AND APPLICATIONS THEREOF UNIWERSYTET MEDYCZNY IM. KAROLA MARCINKOWSKIEGO (PL) 2013-08-08 WO disclosed
EP-1130017-B1 Azole derivatives and their use as superoxide radical inhibitors OTSUKA PHARMA CO LTD (JP) 2005-06-15 EP disclosed
EP-0934937-B1 Azole derivatives as superoxide radical inhibitor OTSUKA PHARMA CO LTD (JP) 2002-02-27 EP disclosed
US-5677319-A THIAZOLE DERIVATIVE OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1997-10-14 US disclosed
US-5643932-A PREVENTS CELL DAMAGE AFTER ISCHEMIA AND RE-PERFUSION, SUBSTITUTED THIAZOLES OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1997-07-01 US disclosed
EP-0513387-A1 ACTIVE OXYGEN INHIBITOR OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1992-11-19 EP disclosed
US-5137889-A Hypotensive agents; coronary vasodilators; calcium antagonists; antiinflammatory agents OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1992-08-11 US disclosed
US-5034395-A Hypotensive agents, carboxylated dihydropyridines OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1991-07-23 US disclosed
US-4795814-A CORONARY VASODILATORS, HYPOTENSIVE AGENTS, ANTIINFLAMMATORY AGENTS, ANTITUMOR AGENTTS, ENZYME INHIBITORS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1989-01-03 US disclosed
EP-0173126-A1 Process for preparing novel dihydropyridine derivatives OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1986-03-05 EP disclosed
EP-0145434-A2 Novel dihydropyridine derivatives and process for preparing the same OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1985-06-19 EP 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-20150080583-A1 QUATERNARY AMMONIUM SALTS, METHOD FOR PREPARATION AND APPLICATIONS THEREOF UFM1, UFL1, UBAP2L LMNA 4462/4885MAPT 1594/4885POLB 862/4885

“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.