SCHEMBL2127289

SCHEMBL2127289

CCCCC(CCC)c1cccc2ccccc12

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
SLC6A4 P31645 1/20 0.43
AOC3 Q16853 1/20 0.39
KMT2A Q03164 1/20 0.38
CYSLTR2 Q9NS75 1/20 0.38
CYSLTR1 Q9Y271 1/20 0.38
GAA P10253 1/20 0.38

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
SCHEMBL11280291 0.96 ALDH1A1 (0.47) ALDH1A1CYP1A2CYP2C9CYP2C19SLC6A4
SCHEMBL19003694 0.95 ALDH1A1 (0.43) ALDH1A1CYP1A2CYP2C9CYP2C19SLC6A4
SCHEMBL30954272 0.93 KDM4E (0.44) ALDH1A1CYP1A2CYP2C9CYP2C19SLC6A4
SCHEMBL10583657 0.93 KDM4E (0.44) ALDH1A1CYP1A2CYP2C9CYP2C19SLC6A4
SCHEMBL10584809 0.93 KDM4E (0.44) ALDH1A1CYP1A2CYP2C9CYP2C19SLC6A4
SCHEMBL10579811 0.93 KDM4E (0.44) ALDH1A1CYP1A2CYP2C9CYP2C19SLC6A4
SCHEMBL10584199 0.93 KDM4E (0.44) ALDH1A1CYP1A2CYP2C9CYP2C19SLC6A4
SCHEMBL10581470 0.93 KDM4E (0.44) ALDH1A1CYP1A2CYP2C9CYP2C19SLC6A4
SCHEMBL10580910 0.93 ALDH1A1 (0.44) ALDH1A1CYP1A2CYP2C9CYP2C19SLC6A4
SCHEMBL1379349 0.93 ALDH1A1 (0.50) ALDH1A1CYP1A2CYP2C9CYP2C19SLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4714794-A BLENDS OF MONOALKYL NAPHTHALENES, ALPHA AND BETA SUBSTITUTED NIPPON OIL CO., LTD. (JP) 1987-12-22 US claimed
EP-1018538-B1 REFRIGERATOR FLUID COMPOSITION NIPPON MITSUBISHI OIL CORP (JP) 2017-03-22 EP disclosed
US-20120096878-A1 Refrigeration Circuit and Method for Improving Same SANDEN CORPORATION (JP) 2012-04-26 US disclosed
EP-2444469-A1 REFRIGERATION CIRCUIT AND METHOD FOR IMPROVING SAME Sanden Corporation (JP) 2012-04-25 EP 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
EP-1018538-A1 REFRIGERATOR OIL COMPOSITION AND REFRIGERATOR FLUID COMPOSITION Nippon Mitsubishi Oil Corporation (JP) 2000-07-12 EP disclosed
EP-0989179-A1 Refrigerating machine oil Nippon Mitsubishi Oil Corporation (JP) 2000-03-29 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
EP-0305114-A1 Heat treating oil NIPPON OIL CO. LTD. (JP) 1989-03-01 EP disclosed
US-4714794-A BLENDS OF MONOALKYL NAPHTHALENES, ALPHA AND BETA SUBSTITUTED NIPPON OIL CO., LTD. (JP) 1987-12-22 US disclosed