SCHEMBL398614

SCHEMBL398614

NCCCC(C1CCCCC1)[PH](=O)O

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.38
KDM4E B2RXH2 1/20 0.37
GMNN O75496 1/20 0.37
LMNA P02545 1/20 0.37
MAPT P10636 1/20 0.37
BLM P54132 1/20 0.37
PMP22 Q01453 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
EPHX1 P07099 2/20 0.36
ALDH1A1 P00352 1/20 0.36
SIGMAR1 Q99720 1/20 0.33
CPB2 Q96IY4 4/20 0.33
MEN1 O00255 1/20 0.31
MITF O75030 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL5509357 0.78 SHBG (0.39) TP53KDM4EGMNNLMNAMAPT
SCHEMBL3384478 0.76 TP53 (0.48) TP53KDM4EGMNNLMNAMAPT
SCHEMBL8503062 0.71 TP53 (0.61) TP53KDM4EGMNNLMNAMAPT
SCHEMBL1088775 0.70 EPHX1 (0.58) TP53KDM4EGMNNLMNAMAPT
SCHEMBL27501949 0.69 ALDH1A1 (0.44) TP53KDM4EGMNNLMNAMAPT
SCHEMBL778438 0.69 EPHX1 (0.31) TP53KDM4EGMNNLMNAMAPT
Hydrochloric Acid SCHEMBL11651717 0.69 EPHX1 (0.56) TP53KDM4EGMNNLMNAMAPT
SCHEMBL4243546 0.69 EPHX1 (0.44) TP53KDM4EGMNNLMNAMAPT
SCHEMBL17923273 0.68 EPHX1 (0.38) TP53KDM4EGMNNLMNAMAPT
SCHEMBL6014461 0.67 EPHX1 (0.43) TP53KDM4EGMNNLMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10103401-B2 Polymer electrolyte composition and polymer electrolyte membrane, polymer electrolyte membrane with catalyst layer, membrane electrode assembly, and polymer electrolyte fuel cell each using the same TORAY INDUSTRIES, INC. (JP) 2018-10-16 US disclosed
EP-3131145-B1 POLYMER ELECTROLYTE COMPOSITION AND POLYMER ELECTROLYTE MEMBRANE, MEMBRANE-ELECTROLYTE ASSEMBLY, AND SOLID POLYMER FUEL CELL USING SAME TORAY INDUSTRIES (JP) 2018-09-05 EP disclosed
US-20170125832-A1 POLYMER ELECTROLYTE COMPOSITION AND POLYMER ELECTROLYTE MEMBRANE, POLYMER ELECTROLYTE MEMBRANE WITH CATALYST LAYER, MEMBRANE ELECTRODE ASSEMBLY, AND POLYMER ELECTROLYTE FUEL CELL EACH USING THE SAME TORAY INDUSTRIES, INC. (JP) 2017-05-04 US disclosed
EP-3131145-A1 POLYMER ELECTROLYTE COMPOSITION AND POLYMER ELECTROLYTE MEMBRANE, MEMBRANE-ELECTROLYTE ASSEMBLY, AND SOLID POLYMER FUEL CELL USING SAME Toray Industries, Inc. (JP) 2017-02-15 EP disclosed
US-8101782-B2 Drug hybrid of rivastigmine or physostigmine with tranylcypromine, amoxapine, desipramine, nortriptyline, protriptyline, fluoxetine, fluvoxamine, paroxetine, duloxetine, betahistine, amlodipine, proylhexedrine, rimantadine, desloratadine; Alzheimer's disease; Parkinson's disease, impairment in memory COLUCID PHARMACEUTICALS, INC. (US) 2012-01-24 US disclosed
US-20110144177-A1 Carbamoyl Esters That Inhibit Cholinesterase And Release Pharmacologically Active Agents COLUCID PHARMACEUTICALS, INC. 2011-06-16 US disclosed
EP-2314571-A2 Carbamoyl esters that inhibit cholinesterase and release pharmacologically active agents CoLucid Pharmaceuticals, Inc. (US) 2011-04-27 EP disclosed
US-7897639-B2 Amine group that, upon hydrolysis, becomes a component of a pharmacologically active agent for treatment of nervous system disordres COLUCID PHARMACEUTICALS, INC. (US) 2011-03-01 US disclosed
US-7795307-B2 Carbamoyl esters that inhibit cholinesterase and release pharmacologically active agents COLUCID PHARMACEUTICALS, INC. (US) 2010-09-14 US disclosed
EP-2125709-A2 COMPOUNDS THAT INHIBIT CHOLINESTERASE Colucid Pharmaceuticals, Inc. (US) 2009-12-02 EP disclosed
US-20080261950-A1 Compounds that inhibit cholinesterase COLUCID PHARMACEUTICALS, INC. (US) 2008-10-23 US disclosed
WO-2008097546-A2 COMPOUNDS THAT INHIBIT CHOLINESTERASE COLUCID PHARMACEUTICALS, INC. (US) 2008-08-14 WO disclosed
US-20070275959-A1 Carbamoyl Esters That Inhibit Cholinesterase And Release Pharmacologically Active Agents SENTION, INC. 2007-11-29 US disclosed
EP-1689704-A2 CARBAMOYL ESTERS THAT INHIBIT CHOLINESTERASE AND RELEASE PHARMACOLOGICALLY ACTIVE AGENTS CoLucid Pharmaceuticals, Inc. (US) 2006-08-16 EP disclosed
WO-2005042475-A2 CARBAMOYL ESTERS THAT INHIBIT CHOLINESTERASE AND RELEASE PHARMACOLOGICALLY ACTIVE AGENTS SENTION, INC. (US) 2005-05-12 WO disclosed
US-20050096387-A1 Carbamoyl esters that inhibit cholinesterase and release pharmacologically active agents SENTION, INC. (US) 2005-05-05 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 (4 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-20110144177-A1 Carbamoyl Esters That Inhibit Cholinesterase And Release Pharmacologically Active Agents ACHE, BCHE, CHAT TP53 3959/4885KDM4E 136/4885GMNN 1526/4885
US-20070275959-A1 Carbamoyl Esters That Inhibit Cholinesterase And Release Pharmacologically Active Agents ACHE, BCHE, CHAT TP53 4290/4885KDM4E 201/4885GMNN 1616/4885
US-20050096387-A1 Carbamoyl esters that inhibit cholinesterase and release pharmacologically active agents ACHE, BCHE, CHAT TP53 3959/4885KDM4E 136/4885GMNN 1526/4885
US-20080261950-A1 Compounds that inhibit cholinesterase ACHE, BCHE, CHAT TP53 4321/4885KDM4E 1137/4885GMNN 978/4885

“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.