SCHEMBL2946754

SCHEMBL2946754

CCCCOC(=O)C#CC(=O)OCCCC

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.58
ATM Q13315 1/20 0.54
TSHR P16473 5/20 0.50
HPGD P15428 1/20 0.50
HCAR2 Q8TDS4 1/20 0.47
NAAA Q02083 1/20 0.46
TDP1 Q9NUW8 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
EPHX1 P07099 1/20 0.43
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA9 Q16790 1/20 0.43
LMNA P02545 1/20 0.42
ESR1 P03372 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2D6 P10635 1/20 0.42
MAPK1 P28482 1/20 0.42
CYP2C19 P33261 1/20 0.42
NR1H2 P55055 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
SCHEMBL2948390 0.95 ALDH1A1 (0.54) ALDH1A1ATMTSHRHPGDHCAR2
SCHEMBL2941839 0.95 ALDH1A1 (0.54) ALDH1A1ATMTSHRHPGDHCAR2
SCHEMBL2942117 0.93 NAAA (0.57) ALDH1A1ATMTSHRHCAR2NAAA
SCHEMBL2945115 0.93 ALDH1A1 (0.52) ALDH1A1ATMTSHRHPGDHCAR2
SCHEMBL2531258 0.93 NAAA (0.56) ALDH1A1ATMTSHRHCAR2NAAA
SCHEMBL2946730 0.91 ALDH1A1 (0.50) ALDH1A1ATMTSHRHPGDHCAR2
SCHEMBL4682515 0.91 ALDH1A1 (0.50) ALDH1A1ATMTSHRHPGDHCAR2
SCHEMBL2946409 0.91 NAAA (0.59) ALDH1A1TSHRHCAR2NAAAEPHX1
SCHEMBL2945479 0.91 NAAA (0.59) ALDH1A1TSHRHCAR2NAAAEPHX1
SCHEMBL2529455 0.91 NAAA (0.59) ALDH1A1TSHRHCAR2NAAAEPHX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4347346-A DIALKYLACETYLENEDICARBOXYITE TO PREVENT PREMATURE GELATION GENERAL ELECTRIC COMPANY (US) 1982-08-31 US claimed
CN-119591754-A Ziegler-Natta catalyst and application thereof 山东京博聚烯烃新材料有限公司 2025-03-11 CN disclosed
CN-119390575-A Maleic acid ester compound, preparation method thereof and application thereof in olefin catalytic polymerization 山东京博聚烯烃新材料有限公司 2025-02-07 CN disclosed
CN-119176891-A Ziegler-Natta catalyst for olefin polymerization and preparation method thereof 中国科学院大连化学物理研究所 2024-12-24 CN disclosed
CN-119161512-A Supported catalyst for olefin polymerization 中国科学院大连化学物理研究所 2024-12-20 CN disclosed
CN-111918883-B Method for producing acrylic rubber, method for producing acrylic rubber composition, and biaxial extrusion dryer for acrylic rubber 日本瑞翁株式会社 2023-05-16 CN disclosed
EP-3352281-B1 NON-AQUEOUS ELECTROLYTE SOLUTION AND NON-AQUEOUS ELECTROLYTE SECONDARY BATTERY ADEKA CORP (JP) 2021-08-11 EP disclosed
CN-108140887-B Nonaqueous electrolyte solution and nonaqueous electrolyte secondary battery 株式会社艾迪科 2021-03-12 CN disclosed
US-10927245-B2 Non-migratory internal plasticizers attached to a pendant covalent linkage THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2021-02-23 US disclosed
US-10927245-B2 Non-migratory internal plasticizers attached to a pendant covalent linkage THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2021-02-23 US disclosed
US-4943601-A Coating with improved adhesion GENERAL ELECTRIC COMPANY (US) 1990-07-24 US disclosed
US-4866095-A 1,8-dihydroxy-9-anthrones for treating warts or psoriasis GROUPEMENT D'INTERET ECONOMIQUE DIT: CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIEQUES C.I.R.D. (FR) 1989-09-12 US disclosed
EP-0201203-A2 Method of treatment of plants with aniline derivatives MAY & BAKER LIMITED (GB) 1986-11-12 EP disclosed
US-4558069-A TREATMENT OF SKIN DISORDERS GROUPEMENT D'INTERET ECONOMIQUE DIT: CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES C.I.R.D. (FR) 1985-12-10 US disclosed
US-4465688-A FOR TREATMENT OF SKIN DISORDERS GROUPEMENT D'INTERET ECONOMIQUE CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES C.I.R.D. (FR) 1984-08-14 US disclosed
US-4464301-A FOR TREATMENT OF PSORIASIS GROUPEMENT D'INTERET ECONOMIQUE CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES C.I.R.D. (FR) 1984-08-07 US disclosed
US-4347346-A DIALKYLACETYLENEDICARBOXYITE TO PREVENT PREMATURE GELATION GENERAL ELECTRIC COMPANY (US) 1982-08-31 US disclosed
US-4340710-A ETHYLENICALLY UNSATURATED ISOCYANURATE AND DIALKYL ACETYLENEDICARBOXYLATE STABILIZERS TO INHIBIT PREMATURE GELATION GENERAL ELECTRIC COMPANY (US) 1982-07-20 US disclosed
US-4281120-A IMMUNE STIMULANTS GRUNENTHAL GMBH (DE) 1981-07-28 US disclosed
US-4237136-A IMMUNOSTIMULANTS GRUNENTHAL GMBH (DE) 1980-12-02 US disclosed