Octane

Octane

SCHEMBL7523713

CC(C)(C)c1cc(Nc2ncnc(S)n2)cc(C(C)(C)C)c1O.CCCCCCCC

nearest known ligand 0.35

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR5A2 O00482 1/20 0.35
NR5A1 Q13285 1/20 0.35
ALDH1A1 P00352 4/20 0.35
GAA P10253 2/20 0.35
TDP1 Q9NUW8 1/20 0.35
PTGS1 P23219 4/20 0.33
KMT2A Q03164 3/20 0.32
MEN1 O00255 2/20 0.32
CYP1A2 P05177 2/20 0.32
CYP3A4 P08684 2/20 0.32
TSHR P16473 2/20 0.32
MAPK1 P28482 2/20 0.32
BLM P54132 2/20 0.32
ATM Q13315 2/20 0.32
HIF1A Q16665 2/20 0.32
NPSR1 Q6W5P4 2/20 0.32
GMNN O75496 1/20 0.32
GABBR2 O75899 1/20 0.32
LMNA P02545 1/20 0.32
TP53 P04637 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
SCHEMBL1668655 0.91 ALDH1A1 (0.41) ALDH1A1GAATDP1PTGS1KMT2A
Octane SCHEMBL38966 0.87 ALDH1A1 (0.38) NR5A2NR5A1ALDH1A1GAATDP1
SCHEMBL28932206 0.84 GAA (0.34) NR5A2NR5A1ALDH1A1GAATDP1
SCHEMBL996080 0.81 PTGS1 (0.35) ALDH1A1GAAPTGS1KMT2AMEN1
SCHEMBL29871074 0.81 ALDH1A1 (0.32) NR5A2NR5A1ALDH1A1GAATDP1
SCHEMBL28284152 0.81 ALDH1A1 (0.32) NR5A2NR5A1ALDH1A1GAATDP1
SCHEMBL6131350 0.81 ALDH1A1 (0.46) ALDH1A1GAATDP1PTGS1KMT2A
SCHEMBL5673679 0.81 GAA (0.33) NR5A2NR5A1ALDH1A1GAATDP1
SCHEMBL28626209 0.80 PTGS2 (0.35) NR5A2NR5A1ALDH1A1GAATDP1
SCHEMBL15061810 0.78 SMN1; SMN2 (0.34) ALDH1A1PTGS1MAPK1LMNAPTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117203272-A Stabilizer mixture 巴斯夫欧洲公司 2023-12-08 CN claimed
CN-117203271-A Use of a stabilizer composition for stabilizing halogen-free thermoplastic recycling material, a stabilizer composition, a masterbatch or concentrate, a stabilized plastic composition, a method for stabilizing halogen-free thermoplastic recycling material and use of a composition 弗劳恩霍夫应用研究促进协会 2023-12-08 CN claimed
CN-115461396-B Additive composition and use thereof, condensation polymer composition, molding compound prepared from same and molded part and use thereof 弗劳恩霍夫应用研究促进协会 2024-07-12 CN disclosed
CN-118234793-A Stabilizer based on syringic acid, vanillic acid, isovanillic acid or 5-hydroxyveratric acid, plastic composition, method for stabilizing a plastic composition and stabilizer composition 弗劳恩霍夫应用研究促进协会 2024-06-21 CN disclosed
CN-118165743-A Polymerizable oligomeric liquid crystals, polymerizable medium and polymerized liquid crystal films 默克专利股份有限公司 2024-06-11 CN disclosed
US-20240174839-A1 STABILIZER MIXTURE BASF SE (DE) 2024-05-30 US disclosed
CN-118076711-A Polymerizable compound, polymerizable LC material and polymer film 默克专利股份有限公司 2024-05-24 CN disclosed
CN-117999310-A Stabilizer formulation 巴斯夫欧洲公司 2024-05-07 CN disclosed
CN-117897427-A Stabilizer combinations for preventing degradation of synthetic polymers 巴斯夫欧洲公司 2024-04-16 CN disclosed
CN-113166467-B Polyethylene or polypropylene articles 巴斯夫欧洲公司 2024-03-29 CN disclosed
CN-114616264-B Oligomer or polymer, composition, use of oligomer or polymer and intermediate 弗劳恩霍夫应用研究促进协会 2024-03-01 CN disclosed
CN-1501952-A Polycarbonates having a low shear thinning ratio 2004-06-02 CN disclosed
CN-1437630-A Stabilizer mixture CIBA SC HOLDING AG (CH) 2003-08-20 CN disclosed
EP-1181330-A1 MIXTURES CONTAINING STABILISERS AND IMINOPHOSPHORANES BASF AKTIENGESELLSCHAFT (DE) 2002-02-27 EP disclosed
EP-1155098-A1 LIQUID CRYSTALLINE SUBSTANCE MIXTURES BASF AKTIENGESELLSCHAFT (DE) 2001-11-21 EP disclosed
WO-2000066661-A1 MIXTURES CONTAINING STABILISERS AND IMINOPHOSPHORANES BASF AKTIENGESELLSCHAFT (DE) 2000-11-09 WO disclosed
WO-2000047694-A1 LIQUID CRYSTALLINE SUBSTANCE MIXTURES BASF AKTIENGESELLSCHAFT (DE) 2000-08-17 WO disclosed
EP-0942037-A1 Polymer dispersions or solutions containing stabilisers and polymer preparations obtainable therefrom BASF AKTIENGESELLSCHAFT (DE) 1999-09-15 EP disclosed
US-5710240-A POLYMERIC STABILIZERS CIBA SPECIALTY CHEMICALS CORPORATION (US) 1998-01-20 US disclosed
US-5350449-A Coating materials stabilized against light-induced degradation CIBA-GEIGY CORPORATION (US) 1994-09-27 US disclosed