SCHEMBL367640

SCHEMBL367640

C=CCC(=O)c1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 1/20 0.58
MAPK1 P28482 3/20 0.56
MAPT P10636 3/20 0.56
HPGD P15428 3/20 0.56
TDP1 Q9NUW8 2/20 0.56
MEN1 O00255 2/20 0.56
CYP3A4 P08684 2/20 0.56
KMT2A Q03164 2/20 0.56
CES1 P23141 2/20 0.56
KDM4E B2RXH2 1/20 0.56
ALOX15 P16050 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
ALDH1A1 P00352 6/20 0.52
GSK3B P49841 2/20 0.52
PTPN1 P18031 2/20 0.52
HIF1A Q16665 2/20 0.52
TRPA1 O75762 1/20 0.52
LMNA P02545 3/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
NR4A2 P43354 1/20 0.50

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
SCHEMBL8189830 0.98 AKT1 (0.56) AKT1MAPK1MAPTHPGDTDP1
Benzophenone SCHEMBL18171700 0.94 ALDH1A1 (0.56) AKT1MAPK1MAPTHPGDTDP1
Oxirane SCHEMBL27647497 0.90 AKT1 (0.48) AKT1MAPK1MAPTHPGDTDP1
SCHEMBL5369410 0.84 HPGD (0.59) AKT1MAPK1MAPTHPGDTDP1
SCHEMBL11060279 0.83 ERCC5 (0.58) SMN1; SMN2ALDH1A1ERCC5FEN1POLB
Hydrogen Sulfide SCHEMBL28307424 0.83 ALDH1A1 (0.48) AKT1MAPK1MAPTHPGDTDP1
SCHEMBL289107 0.83 AKT1 (0.54) AKT1MAPK1MAPTHPGDTDP1
SCHEMBL14102466 0.82 CA12 (0.52) AKT1HPGDHTTTSHRCYP1A2
SCHEMBL28264973 0.82 MAPK1 (0.56) AKT1MAPK1MAPTHPGDTDP1
SCHEMBL11070858 0.81 TDP1 (0.61) AKT1MAPK1MAPTHPGDTDP1

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

Appears in 2317 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114086135-B Electroluminescence film and preparation method thereof 苏州瑞纳新材料科技有限公司 2024-05-24 CN claimed
CN-113943504-B Active energy ray-curable coating agent, cured product, and laminate 荒川化学工业株式会社 2024-05-10 CN claimed
CN-115490668-B Pyrimidylimidazole compound, preparation method thereof and organic solderability preservative 深圳市贝加电子材料有限公司 2024-04-02 CN claimed
CN-117280252-A Multifocal diffractive silicone hydrogel contact lenses 爱尔康公司 2023-12-22 CN claimed
CN-116554393-A Curable composition, film, laminate, and display device 住友化学株式会社 2023-08-08 CN claimed
CN-114262557-B Photovoltaic backboard inner layer coating, photovoltaic backboard, preparation method of photovoltaic backboard and photovoltaic module 福斯特(嘉兴)新材料有限公司 2023-07-14 CN claimed
CN-115490668-A Pyrimidyl imidazole compound, preparation method thereof and organic weldable protective agent 深圳市贝加电子材料有限公司 2022-12-20 CN claimed
CN-114867708-A Method for synthesizing benzyl ether from polyhydroxyphenol 泉州海创医药科技有限公司 2022-08-05 CN claimed
CN-109415552-B Plasticized thermoset resins and related cured resins, methods of curing, and articles comprising the cured resins 马萨诸塞大学 2022-08-05 CN claimed
CN-109415553-B Plasticized thermoset resins and related cured resins, curing methods, and articles comprising cured resins 马萨诸塞大学 2022-08-05 CN claimed
EP-0233291-A1 2-ARYLBENZOTHIAZINE DERIVATIVES SANTEN PHARMACEUTICAL CO., LTD. (JP) 1987-08-26 EP claimed
US-4670582-A Process for the preparation of unsaturated carboxylate esters SHELL OIL COMPANY (US) 1987-06-02 US claimed
EP-0218282-A1 Process for the preparation of unsaturated carboxylate esters SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1987-04-15 EP claimed
US-H122-H PYRAZOLOAZOLE-TYPE MAGENTA COUPLER DISPERSED IN A HIGH-BOILING PHOSPHATE SOLVENT FUJI PHOTO FILM CO., LTD. (JP) 1986-09-02 US claimed
CN-85108556-A The preparation method of novel benzoxazol base and benzothiazolyl amino derivative and application thereof 1986-07-30 CN claimed
US-4289847-A 2-EQUIVALENT YELLOW COUPLER KONISHIROKU PHOTO INDUSTRY CO., LTD. (JP) 1981-09-15 US claimed
EP-0019787-A2 2-Phenylalken-1-yl-cyclopropane-carboxylic acid esters, process for their preparation and their use as insecticides and acaricides; intermediates in their preparation BAYER AG (DE) 1980-12-10 EP claimed
US-4171444-A REACTING A (HETERO-)AROMATIC KETONE, AMMONIA, AND AN ALIPHATIC ALDEHYDE, DEHYDRATING-DEHYDROGENATION CATALYSTS DEUTSCHE GOLD- UND SILBER-SCHEIDEANSTALT VORMALS ROESSLER (DE) 1979-10-16 US claimed
US-4052459-A FROM BENZENE, ACYLATION, CATALYTIC HYDROGENATION, ACETYLATION SOLVAY & CIE (BE) 1977-10-04 US claimed
US-3944627-A TO ALKYLBENZENES, GROUP 8 METAL SUPPORTED CATALYST SHELL OIL COMPANY (US) 1976-03-16 US claimed