SCHEMBL1178413

SCHEMBL1178413

C=C=C=Cc1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.43
TSHR P16473 1/20 0.43
MAOB P27338 2/20 0.38
CYP2A6 P11509 1/20 0.38
LMNA P02545 3/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
IDO1 P14902 2/20 0.32
GRIN2D O15399 2/20 0.32
GRIN3B O60391 2/20 0.32
GRIN1 Q05586 2/20 0.32
GRIN2A Q12879 2/20 0.32
GRIN2B Q13224 2/20 0.32
GRIN2C Q14957 2/20 0.32
GRIN3A Q8TCU5 2/20 0.32
TAAR1 Q96RJ0 1/20 0.32
NFE2L2 Q16236 1/20 0.32
CYP19A1 P11511 1/20 0.32
MAOA P21397 1/20 0.32
TRPA1 O75762 1/20 0.32
ALOX5 P09917 1/20 0.32

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
Ammonia Solution, Strong SCHEMBL9795266 0.80 ALDH1A1 (0.43) ALDH1A1TSHRMAOBCYP2A6LMNA
SCHEMBL370016 0.78
Water SCHEMBL28150278 0.76 ALDH1A1 (0.46) ALDH1A1TSHRMAOBCYP2A6LMNA
SCHEMBL27895709 0.76 ALDH1A1 (0.46) ALDH1A1TSHRMAOBCYP2A6LMNA
Fluoride SCHEMBL28325331 0.74 ALDH1A1 (0.43) ALDH1A1TSHRMAOBCYP2A6LMNA
SCHEMBL4333668 0.74 ALDH1A1 (0.38) ALDH1A1TSHRMAOBCYP2A6LMNA
SCHEMBL5701503 0.74 ALDH1A1 (0.43) ALDH1A1TSHRMAOBCYP2A6LMNA
SCHEMBL11879326 0.72 MAOB (0.36) ALDH1A1TSHRMAOBCYP2A6LMNA
SCHEMBL4336102 0.72 APP (0.39) ALDH1A1TSHRMAOBCYP2A6LMNA
Water SCHEMBL27514949 0.72 ALDH1A1 (0.42) ALDH1A1TSHRMAOBCYP2A6LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109643758-B Crosslinked p-type dopants for p-type doping of organic hole conductors 默克专利股份有限公司 2023-05-02 CN claimed
CN-118829686-A Resin composition, prepreg, resin-coated film, resin-coated metal foil, metal foil-clad laminate, and wiring board 松下知识产权经营株式会社 2024-10-22 CN disclosed
CN-115651372-A High-weather-resistance material for air inlet grille, preparation method and air inlet grille 河南天海合聚新材料有限公司 2023-01-31 CN disclosed
CN-111925624-A High-low temperature resistant soft sound insulation material and preparation method thereof 株洲时代新材料科技股份有限公司 2020-11-13 CN disclosed
US-8349911-B2 Silane-based, aqueous coating system, production and use thereof EVONIK DEGUSSA GMBH (DE) 2013-01-08 US disclosed
US-20110039972-A1 SILANE-BASED, AQUEOUS COATING SYSTEM, PRODUCTION AND USE THEREOF EVONIK DEGUSSA GMBH (DE) 2011-02-17 US disclosed