SCHEMBL838634

SCHEMBL838634

O=C(O)C1CCCCC1c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNQ3 O43525 2/20 0.56
KCNQ2 O43526 2/20 0.56
SLC6A2 P23975 1/20 0.54
SLC6A4 P31645 1/20 0.54
HPGD P15428 1/20 0.51
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
FABP7 O15540 2/20 0.49
FABP3 P05413 2/20 0.49
FABP5 Q01469 2/20 0.49
AKR1C3 P42330 1/20 0.47
AKR1C1 Q04828 1/20 0.47
LMNA P02545 2/20 0.46
RAB9A P51151 1/20 0.46
GAA P10253 1/20 0.46
MAPT P10636 1/20 0.46
FFAR1 O14842 1/20 0.46
HDAC4 P56524 1/20 0.46
HRH3 Q9Y5N1 1/20 0.45
HTT P42858 1/20 0.45

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
SCHEMBL12354198 1.00 KCNQ3 (0.56) KCNQ3KCNQ2SLC6A2SLC6A4HPGD
SCHEMBL22492062 1.00 KCNQ3 (0.56) KCNQ3KCNQ2SLC6A2SLC6A4HPGD
SCHEMBL22492058 1.00 KCNQ3 (0.56) KCNQ3KCNQ2SLC6A2SLC6A4HPGD
SCHEMBL1752024 0.98 SLC6A2 (0.56) KCNQ3KCNQ2SLC6A2SLC6A4HPGD
SCHEMBL1752183 0.98 SLC6A2 (0.56) KCNQ3KCNQ2SLC6A2SLC6A4HPGD
SCHEMBL12592461 0.98 SLC6A2 (0.56) KCNQ3KCNQ2SLC6A2SLC6A4HPGD
SCHEMBL4522521 0.96 KCNQ3 (0.53) KCNQ3KCNQ2SLC6A2SLC6A4HPGD
SCHEMBL7352068 0.96 KCNQ3 (0.53) KCNQ3KCNQ2SLC6A2SLC6A4HPGD
SCHEMBL12592455 0.96 KCNQ3 (0.53) KCNQ3KCNQ2SLC6A2SLC6A4HPGD
SCHEMBL7352063 0.96 KCNQ3 (0.53) KCNQ3KCNQ2SLC6A2SLC6A4HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11332472-B2 Substituted piperidines as inhibitors of ubiquitin specific protease 7 LES LABORATOIRES SERVIER (FR) 2022-05-17 US disclosed
CN-112368276-A Amino-pyrimidinone derivatives, process for their preparation and pharmaceutical compositions containing them 法国施维雅药厂 2021-02-12 CN disclosed
US-20200407363-A1 NEW PIPERIDINYL DERIVATIVES AS INHIBITORS OF UBIQUITIN SPECIFIC PROTEASE 7 LES LABORATOIRES SERVIER (FR) 2020-12-31 US disclosed
EP-3717482-A1 NEW PIPERIDINYL DERIVATIVES AS INHIBITORS OF UBIQUITIN SPECIFIC PROTEASE 7 Les Laboratoires Servier SAS (FR) 2020-10-07 EP disclosed
CN-111542524-A Novel piperidinyl derivatives as inhibitors of ubiquitin-specific protease 7 法国施维雅药厂 2020-08-14 CN disclosed
US-20160221948-A1 NITROGEN-CONTAINING SATURATED HETEROCYCLIC COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-08-04 US disclosed
US-20130253201-A1 PROCESS FOR THE PREPARATION OF ENANTIOMERICALLY ENRICHED CYCLIC BETA-ARYL OR HETEROARYL CARBOCYCLIC ACIDS HOFFMANN-LA ROCHE INC. (US) 2013-09-26 US disclosed
EP-2513098-A1 AMINOPYRIMIDINES AS SYK INHIBITORS Merck Sharp & Dohme Corp. (US) 2012-10-24 EP disclosed
CN-101460461-B Process for preparation of enantiomerically enriched cyclic beta-aryl or heteroaryl carboxylic acids HOFFMANN LA ROCHE 2012-10-03 CN disclosed
US-8143405-B2 Piperidine and pyrrolidine beta-secretase inhibitors for the treatment of alzheimer's disease Merck, Sharp & Dohme Corp (US) 2012-03-27 US disclosed
EP-2029541-A1 PROCESS FOR PREPARATION OF ENANTIOMERICALLY ENRICHED CYCLIC BETA-ARYL OR HETEROARYL CARBOXYLIC ACIDS F. Hoffmann-Roche AG (CH) 2009-03-04 EP disclosed
WO-2007113155-A1 PROCESS FOR PREPARATION OF ENANTIOMERICALLY ENRICHED CYCLIC Β-ARYL OR HETEROARYL CARBOXYLIC ACIDS F. HOFFMANN-LA ROCHE AG (CH) 2007-10-11 WO disclosed
US-20070232653-A1 Process for the preparation of enantiomerically enriched cyclic beta-aryl or heteroaryl carbocyclic acids HOFFMANN-LA ROCHE INC. 2007-10-04 US disclosed
EP-0758013-B1 Liquid crystalline optical film, compensating film for liquid crystal display and liquid crystal display NIPPON OIL CO LTD (JP) 2000-10-11 EP disclosed
US-5855971-A Liquid crystalline optical film, compensating film for liquid crystal display comprising the liquid crystalline optical film, and liquid crystal display having the compensating film NIPPON OIL COMPANY, LIMITED (JP) 1999-01-05 US disclosed
EP-0758013-A1 Liquid crystalline optical film, compensating film for liquid crystal display and liquid crystal display NIPPON OIL COMPANY, LIMITED (JP) 1997-02-12 EP disclosed
EP-0698010-A1 N-ACYL SULFAMIC ACID ESTERS (OR THIOESTERS), N-ACYL SULFONAMIDES, AND N-SULFONYL CARBAMIC ACID ESTERS (OR THIOESTERS) AS HYPERCHOLESTEROLEMIC AGENTS WARNER-LAMBERT COMPANY (US) 1996-02-28 EP disclosed
US-5462964-A Administering to treat thrombosis THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1995-10-31 US disclosed
WO-1995009858-A1 DIPEPTIDE BORONIC ACID INHIBITORS OF TRYPSIN-LIKE ENZYMES THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1995-04-13 WO disclosed
US-4017552-A Bicyclo-[3'3'0]-octa-2-ene formed by isomerizing 1,5-cyclooctadiene THE GOODYEAR TIRE & RUBBER COMPANY (US) 1977-04-12 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 (5 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-20160221948-A1 NITROGEN-CONTAINING SATURATED HETEROCYCLIC COMPOUND H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, H1-4, HRH4 KCNQ3 2115/4885KCNQ2 2516/4885SLC6A2 227/4885
US-11332472-B2 Substituted piperidines as inhibitors of ubiquitin specific protease 7 USP7, PSMA7, PSMB7 KCNQ3 4231/4885KCNQ2 3921/4885SLC6A2 4768/4885
US-20130253201-A1 PROCESS FOR THE PREPARATION OF ENANTIOMERICALLY ENRICHED CYCLIC BETA-ARYL OR HETEROARYL CARBOCYCLIC ACIDS AHR, CYP8B1, ADRA2C KCNQ3 3897/4885KCNQ2 4164/4885SLC6A2 2332/4885
US-20070232653-A1 Process for the preparation of enantiomerically enriched cyclic beta-aryl or heteroaryl carbocyclic acids AHR, CYP8B1, ADRA2C KCNQ3 3897/4885KCNQ2 4164/4885SLC6A2 2332/4885
US-20200407363-A1 NEW PIPERIDINYL DERIVATIVES AS INHIBITORS OF UBIQUITIN SPECIFIC PROTEASE 7 PSMB7, PSMA7, USP7 KCNQ3 4378/4885KCNQ2 3943/4885SLC6A2 4853/4885

“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.