SCHEMBL8106600

SCHEMBL8106600

Cc1c(O)c(C)c(C(C)(C)C)c(C)c1C(C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CA2 P00918 3/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
ALDH1A1 P00352 1/20 0.36
POLB P06746 1/20 0.36
TYR P14679 1/20 0.36
CYP2C9 P11712 2/20 0.32
CYP2C19 P33261 2/20 0.32
GABRA1 P14867 1/20 0.32
GABRB2 P47870 1/20 0.32
CYP1A2 P05177 1/20 0.32
CA1 P00915 1/20 0.32
TP53 P04637 1/20 0.30
HIF1A Q16665 1/20 0.30
PTGS1 P23219 1/20 0.30
PTGS2 P35354 1/20 0.30

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
SCHEMBL2741240 0.85 CA2 (0.35) CA2SMN1; SMN2ALDH1A1POLBTYR
SCHEMBL784952 0.84 CA2 (0.38) CA2SMN1; SMN2ALDH1A1POLBTYR
SCHEMBL15504703 0.82 ALDH1A1 (0.33) CA2SMN1; SMN2ALDH1A1POLBTYR
SCHEMBL784967 0.81 CA2 (0.36) CA2SMN1; SMN2ALDH1A1POLBTYR
SCHEMBL11656526 0.80 ALDH1A1 (0.32) CA2SMN1; SMN2ALDH1A1POLBTYR
SCHEMBL9068216 0.79 CA2 (0.35) CA2SMN1; SMN2ALDH1A1POLBTYR
SCHEMBL18268232 0.78
SCHEMBL2741247 0.77 ALDH1A1 (0.33) CA2SMN1; SMN2ALDH1A1POLBTYR
SCHEMBL2457445 0.77 TP53 (0.34) SMN1; SMN2CYP2C9CYP2C19TP53HIF1A
SCHEMBL7907472 0.75 CA2 (0.36) CA2SMN1; SMN2ALDH1A1POLBTYR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111234395-A Novel antiagglomerating agents for the production of polyisobutenes 巴斯夫东南亚有限公司 2020-06-05 CN claimed
EP-0743496-B1 Refrigeration system using hydrofluorocarbon refrigerant MITSUBISHI ELECTRIC CORP (JP) 2000-05-31 EP disclosed
EP-0738859-B1 Refrigeration system using hydrofluorocarbon refrigerant MITSUBISHI ELECTRIC CORP (JP) 2000-05-31 EP disclosed
EP-0738858-B1 Method of assembling refrigeration system using hydrofluorocarbon refrigerant MITSUBISHI ELECTRIC CORP (JP) 2000-05-31 EP disclosed
EP-0622445-B1 Refrigerant circulating system MITSUBISHI ELECTRIC CORP (JP) 1999-09-15 EP disclosed
EP-0852323-A2 Refrigerant circulating system MITSUBISHI DENKI KABUSHIKI KAISHA (JP) 1998-07-08 EP disclosed
EP-0846925-A2 Refrigerant circulating system MITSUBISHI DENKI KABUSHIKI KAISHA (JP) 1998-06-10 EP disclosed
EP-0846926-A2 Refrigerant circulating system MITSUBISHI DENKI KABUSHIKI KAISHA (JP) 1998-06-10 EP disclosed
EP-0846751-A2 Refrigerant circulating system MITSUBISHI DENKI KABUSHIKI KAISHA (JP) 1998-06-10 EP disclosed
EP-0844300-A2 Refrigerant circulating system MITSUBISHI DENKI KABUSHIKI KAISHA (JP) 1998-05-27 EP disclosed
EP-0600131-B1 Refrigeration device using hydrofluorocarbon refrigerant MITSUBISHI ELECTRIC CORP (JP) 1997-03-05 EP disclosed
EP-0743496-A2 Refrigeration system using hydrofluorocarbon refrigerant MITSUBISHI DENKI KABUSHIKI KAISHA (JP) 1996-11-20 EP disclosed
EP-0738858-A2 Method of assembling refrigeration system using hydrofluorocarbon refrigerant MITSUBISHI DENKI KABUSHIKI KAISHA (JP) 1996-10-23 EP disclosed
EP-0738859-A2 Refrigeration system using hydrofluorocarbon refrigerant MITSUBISHI DENKI KABUSHIKI KAISHA (JP) 1996-10-23 EP disclosed
US-5342533-A Containing ester oil and phosphate or phosphite oils MITSUBISHI OIL CO., LTD. (JP) 1994-08-30 US disclosed
EP-0600131-A1 Refrigeration device using hydrofluorocarbon refrigerant MITSUBISHI DENKI KABUSHIKI KAISHA (JP) 1994-06-08 EP disclosed