SCHEMBL2687693

SCHEMBL2687693

Nc1cc(C2CCCCC2)ccc1O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACMSD Q8TDX5 2/20 0.57
BACE1 P56817 2/20 0.47
HDAC2 Q92769 3/20 0.47
HDAC4 P56524 1/20 0.47
HDAC8 Q9BY41 1/20 0.47
QDPR P09417 3/20 0.46
NOS3 P29474 2/20 0.43
NOS1 P29475 2/20 0.43
NOS2 P35228 2/20 0.43
NUDT1 P36639 1/20 0.42
KMO O15229 1/20 0.42
ALDH1A1 P00352 3/20 0.41
ALOX15 P16050 2/20 0.41
HSD17B10 Q99714 2/20 0.41
HPGD P15428 1/20 0.41
ALOX12 P18054 1/20 0.41
MAPK1 P28482 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
HDAC1 Q13547 2/20 0.40
KDM4E B2RXH2 1/20 0.40

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
SCHEMBL28096625 1.00 ACMSD (0.57) ACMSDBACE1HDAC2HDAC4HDAC8
SCHEMBL10536451 0.98 ACMSD (0.56) ACMSDBACE1HDAC2HDAC4HDAC8
SCHEMBL3985023 0.82 BACE1 (0.51) ACMSDBACE1HDAC2NOS3NOS1
SCHEMBL68815 0.82 QDPR (0.66) ACMSDBACE1HDAC2HDAC4HDAC8
SCHEMBL7932026 0.80 ACMSD (0.61) ACMSDBACE1HDAC2HDAC4HDAC8
SCHEMBL1291751 0.79 QDPR (0.68) ACMSDBACE1HDAC2HDAC4HDAC8
SCHEMBL15156130 0.79 BACE1 (0.49) ACMSDBACE1HDAC2HDAC4HDAC8
SCHEMBL7561294 0.79 ACMSD (0.56) ACMSDBACE1HDAC2HDAC4HDAC8
SCHEMBL5289225 0.78 BACE1 (0.49) ACMSDBACE1HDAC2HDAC4HDAC8
SCHEMBL19665789 0.78 ACMSD (0.59) ACMSDBACE1HDAC2HDAC4HDAC8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118909227-A Phenol-containing amine adduct and preparation method thereof 江苏富琪森新材料有限公司 2024-11-08 CN claimed
CN-102766009-A Sulfonated phenols with nitrophenols as polymerization inhibitors CHEMTURA CORP 2012-11-07 CN claimed
CN-100564332-C Sulfonated nitrophenols as polymerization inhibitors CHEMTURA CORP (US) 2009-12-02 CN claimed
CN-101102984-A Aromatic sulfonic acids, amines, and nitrophenols in combination with nitroxyl radical-containing compounds or C-nitrsoanilines as polymerization inhibitors CHEMTURA CORP (US) 2008-01-09 CN claimed
CN-101044106-A Sulfonated phenols and nitrophenols as polymerization inhibitors CHEMTURA CORP (US) 2007-09-26 CN claimed
CN-101031528-A Sulfonated nitrophenols as polymerization inhibitors CHEMTURA CORP (US) 2007-09-05 CN claimed
CN-118909227-A Phenol-containing amine adduct and preparation method thereof 江苏富琪森新材料有限公司 2024-11-08 CN disclosed
CN-113820920-B Photosensitive resin composition, method for producing cured relief pattern, and semiconductor device 旭化成株式会社 2023-07-04 CN disclosed
CN-113820920-A Photosensitive resin composition, method for producing cured relief pattern, and semiconductor device 旭化成株式会社 2021-12-21 CN disclosed
CN-107850844-B Photosensitive resin composition, method for producing cured relief pattern, and semiconductor device 旭化成株式会社 2021-09-07 CN disclosed
CN-107266857-B Thermosetting resin composition 旭化成株式会社 2020-04-14 CN disclosed
US-8829035-B2 Agent for treatment or prevention of diseases associated with activity of neurotrophic factors SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-09-09 US disclosed
EP-2436683-B1 AGENT FOR TREATMENT OR PREVENTION OF DISEASES ASSOCIATED WITH ACTIVITY OF NEUROTROPHIC FACTORS SUMITOMO CHEMICAL CO (JP) 2014-05-14 EP disclosed
US-5093504-A PRODUCTION OF THIOPHENE-2,5-DICARBOXYLIC ACID DIESTERS, TETRAHYDROTHIOPHENE-2,5-DICARBOXYLIC ACID DIESTERS AND DIBENZOXAZOLYLTHIOPHENES SUMITOMO SEIKA CHEMICALS, CO., LTD. (JP) 1992-03-03 US disclosed
EP-0387725-A2 Production of thiophene-2,5-dicarboxylic acid diesters and tetrahydrothiophene-2,5-dicarboxylic acid diesters SUMITOMO SEIKA CHEMICALS CO., LTD. (JP) 1990-09-19 EP disclosed
US-4859661-A Alkyl-substituted benzoxazinorifamycin derivative, process for preparing the same and antibacterial agent containing the same KANEGAFUCHI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1989-08-22 US disclosed
CN-87104870-A Benzoxazinnorifamyciderivative derivative, its preparation method that alkyl replaces and contain the antiseptic-germicide of this derivative 1988-02-17 CN disclosed
EP-0253340-A1 Alkyl-substituted benzoxazinorifamycin derivative, process for preparing the same and antibacterial agent containing the same KANEGAFUCHI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1988-01-20 EP disclosed
US-4119634-A BRIGHTENERS FOR PLASTICS AND POLYESTERS BAYER AKTIENGESELLSCHAFT (DE) 1978-10-10 US disclosed
US-3985763-A DYESTUFFS BAYER AKTIENGESELLSCHAFT (DT) 1976-10-12 US disclosed