SCHEMBL6546299

SCHEMBL6546299

Cc1ccc(C(C)C(C)c2ccc(C)cc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 7/20 0.53
TDP1 Q9NUW8 1/20 0.53
CHRNA7 P36544 1/20 0.50
ALOX5 P09917 1/20 0.41
ALDH1A1 P00352 2/20 0.40
CA7 P43166 2/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA9 Q16790 1/20 0.40
CYP19A1 P11511 1/20 0.38
STAT3 P40763 1/20 0.38
TSHR P16473 3/20 0.37
LMNA P02545 1/20 0.37
ALOX12 P18054 1/20 0.37
MEN1 O00255 1/20 0.37
GAA P10253 1/20 0.37
KMT2A Q03164 1/20 0.37
MAOA P21397 2/20 0.36
MAOB P27338 1/20 0.36
GRIA4 P48058 1/20 0.35

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
SCHEMBL6548164 0.89 LMNA (0.50) ACHETDP1CHRNA7TSHRLMNA
SCHEMBL19200933 0.88 ACHE (0.47) ACHETDP1CHRNA7ALOX5ALDH1A1
SCHEMBL18409817 0.84 TEAD4 (0.54) ACHETDP1CHRNA7ALDH1A1TSHR
SCHEMBL13699289 0.83 CHRNA7 (0.42) ACHETDP1CHRNA7ALOX5ALDH1A1
SCHEMBL9397881 0.83 CHRNA7 (0.42) ACHETDP1CHRNA7ALOX5ALDH1A1
SCHEMBL24932643 0.83 CHRNA7 (0.42) ACHETDP1CHRNA7ALOX5ALDH1A1
SCHEMBL13750635 0.83 CHRNA7 (0.42) ACHETDP1CHRNA7ALOX5ALDH1A1
SCHEMBL19122171 0.83 CHRNA7 (0.42) ACHETDP1CHRNA7ALOX5ALDH1A1
SCHEMBL20807949 0.81 CHRNA7 (0.41) ACHETDP1CHRNA7ALOX5CA7
SCHEMBL4742912 0.81 CHRNA7 (0.41) ACHETDP1CHRNA7ALOX5ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109852444-B Preparation method of gasoline octane number improver 山东聚兴新材料科技有限公司 2021-01-29 CN claimed
CN-109852443-B Gasoline octane number improver and preparation method thereof 山东聚兴新材料科技有限公司 2021-01-29 CN claimed
CN-109852444-A A kind of preparation method of Gasoline octane number enhancer 山东聚兴新材料科技有限公司 2019-06-07 CN claimed
CN-109852444-B Preparation method of gasoline octane number improver 山东聚兴新材料科技有限公司 2021-01-29 CN disclosed
CN-109852443-B Gasoline octane number improver and preparation method thereof 山东聚兴新材料科技有限公司 2021-01-29 CN disclosed
CN-107250107-B The crystal modifications of N- (2- (3- phenylcarbamido) phenyl) benzsulfamide and the recording materials for using the crystal modifications 日本曹达株式会社 2019-08-09 CN disclosed
CN-109852444-A A kind of preparation method of Gasoline octane number enhancer 山东聚兴新材料科技有限公司 2019-06-07 CN disclosed
CN-109852443-A A kind of Gasoline octane number enhancer and preparation method thereof 山东聚兴新材料科技有限公司 2019-06-07 CN disclosed
CN-107250107-A N‑(2‑(3 phenylcarbamidos)Phenyl)The crystal modifications of benzsulfamide and the recording materials using the crystal modifications 日本曹达株式会社 2017-10-13 CN disclosed
CN-104797429-B Recording material using non-phenolic compound, recording sheet, and method for using non-phenolic compound for color developer 日本曹达株式会社 2017-04-19 CN disclosed
EP-0717098-B1 A refrigerating machine oil and a fluid composition for use in a refrigerating machine NIPPON MITSUBISHI OIL CORP (JP) 2004-01-21 EP disclosed
US-5817251-A AROMATIC HYDROCARBON LUBRICANT NIPPON OIL CO., LTD. (JP) 1998-10-06 US disclosed
US-5711895-A Fluid composition for use in a refrigerating machine in which the refrigerating machine oil is at least one hydrocarbon compound of a formula consisting of two phenyl groups joined through an alkylene or alkenylene group NIPPON OIL CO., LTD. (JP) 1998-01-27 US disclosed
EP-0717098-A2 A refrigerating machine oil and a fluid composition for use in a refrigerating machine NIPPON OIL CO. LTD. (JP) 1996-06-19 EP disclosed