SCHEMBL4669286

SCHEMBL4669286

O=C(Cl)OCC1CCCO1

nearest known ligand 0.64

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.64
POLB P06746 1/20 0.64
ALDH1A1 P00352 1/20 0.60
NPSR1 Q6W5P4 1/20 0.48
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
USP2 O75604 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42

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
SCHEMBL6443856 1.00 LMNA (0.64) LMNAPOLBALDH1A1NPSR1MEN1
SCHEMBL6443863 1.00 LMNA (0.64) LMNAPOLBALDH1A1NPSR1MEN1
SCHEMBL8460521 0.94 LMNA (0.57) LMNAPOLBALDH1A1
SCHEMBL1469483 0.84 LMNA (0.68) LMNAPOLBALDH1A1NPSR1MEN1
SCHEMBL6945700 0.82 ALDH1A1 (0.67) LMNAPOLBALDH1A1NPSR1
SCHEMBL5078328 0.82 LMNA (0.57) LMNAPOLBALDH1A1NPSR1
SCHEMBL25323826 0.81 LMNA (0.70) LMNAPOLBALDH1A1NPSR1
SCHEMBL8845308 0.81 LMNA (0.64) LMNAPOLBALDH1A1NPSR1MEN1
SCHEMBL10290385 0.81 LMNA (0.64) LMNAPOLBALDH1A1NPSR1MEN1
SCHEMBL23049101 0.81 LMNA (0.64) LMNAPOLBALDH1A1NPSR1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5187306-A Reacting unsaturated amides with metallic bases to form metal salts, which are reacted with halogenated formic acid esters NIPPON PAINT CO., LTD. (JP) 1993-02-16 US claimed
US-20210040041-A1 QUINOLINE DERIVATIVES AND PREPARATION METHODS AND USES THEREOF Dongguan HEC Pesticides R&D Co., Ltd. (CN) 2021-02-11 US disclosed
US-20080194629-A1 3-Mono-and 3,5-Disubstituted Piperidine Derivatives as Renin Inhibitors BAESCHLIN DANIEL KASPAR 2008-08-14 US disclosed
CN-101171248-A 3-mono- and 3,5-disubstituted piperidine derivatives as renin inhibitors NOVARTIS AG (CH) 2008-04-30 CN disclosed
EP-1879882-A1 3 -M0N0- AND 3 , 5-DISUBSTITUTED PIPERIDINE DERIVATIVES AS RENIN INHIBITORS Novartis AG (CH) 2008-01-23 EP disclosed
WO-2006117183-A1 3 -M0N0- AND 3 , 5-DISUBSTITUTED PIPERIDINE DERIVATIVES AS RENIN INHIBITORS NOVARTIS AG (CH) 2006-11-09 WO disclosed
US-20050014787-A1 5-amidino-2-hydroxybenzenesulfonamide derivatives medicinal compoistions containing the same medicinal use thereof and intermediates in the production thereof KISSEI PHARMACEUTICAL CO., LTD. (JP) 2005-01-20 US disclosed
EP-1443041-A1 5-AMIDINO-2-HYDROXYBENZENESULFONAMIDE DERIVATIVES, MEDICINAL COMPOSITIONS CONTAINING THE SAME, MEDICINAL USE THEREOF AND INTERMEDIATES IN THE PRODUCTION THEREOF Kissei Pharmaceutical Co., Ltd. (JP) 2004-08-04 EP disclosed
EP-1392315-A1 METHODS OF TREATING ALZHEIMER'S DISEASE Elan Pharmaceuticals, Inc. (US) 2004-03-03 EP disclosed
WO-2002100410-A1 METHODS OF TREATING ALZHEIMER'S DISEASE ELAN PHARMACEUTICALS, INC. (US) 2002-12-19 WO disclosed
US-5434296-A Reacting carbamate with metallic base to form salt; reacting with unsaturated acid halide to acylate NIPPON PAINT CO., LTD. (JP) 1995-07-18 US disclosed
EP-0465162-B1 Process for producing unsaturated carbamic acid esters NIPPON PAINT CO LTD (JP) 1994-12-07 EP disclosed
US-5187306-A Reacting unsaturated amides with metallic bases to form metal salts, which are reacted with halogenated formic acid esters NIPPON PAINT CO., LTD. (JP) 1993-02-16 US disclosed
EP-0465162-A1 Process for producing unsaturated carbamic acid esters NIPPON PAINT CO., LTD. (JP) 1992-01-08 EP disclosed
US-4376731-A 2-NITRILES THEREOF BOEHRINGER MANNHEIM GMBH (DE) 1983-03-15 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 (3 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-20210040041-A1 QUINOLINE DERIVATIVES AND PREPARATION METHODS AND USES THEREOF NQO2, RDX, RIN1 LMNA 3149/4885POLB 3689/4885ALDH1A1 1655/4885
US-20050014787-A1 5-amidino-2-hydroxybenzenesulfonamide derivatives medicinal compoistions containing the same medicinal use thereof and intermediates in the production thereof F2, HYPK, F10 LMNA 1435/4885POLB 3016/4885ALDH1A1 3117/4885
US-20080194629-A1 3-Mono-and 3,5-Disubstituted Piperidine Derivatives as Renin Inhibitors REN, ACE, AGTR1 LMNA 1399/4885POLB 1855/4885ALDH1A1 231/4885

“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.