SCHEMBL446680

SCHEMBL446680

CC(C)c1cc(C(C)C)c(C([O])=O)c(C(C)C)c1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FABP4 P15090 3/20 0.69
FABP3 P05413 2/20 0.69
FABP5 Q01469 1/20 0.50
GABRA1 P14867 1/20 0.48
GABRB2 P47870 1/20 0.48
GAA P10253 3/20 0.36
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
SOAT2 O75908 1/20 0.34
MYC P01106 1/20 0.34
SOAT1 P35610 1/20 0.34
MAP2K3 P46734 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
EIF4A3 P38919 1/20 0.33
KDM4E B2RXH2 1/20 0.33
HDAC1 Q13547 1/20 0.33
RARG P13631 1/20 0.33
RXRA P19793 1/20 0.33
PPARG P37231 1/20 0.33

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
SCHEMBL2383444 0.82 FABP4 (0.69) FABP4FABP3FABP5GABRA1GABRB2
SCHEMBL810177 0.82 FABP3 (1.00) FABP4FABP3FABP5GABRA1GABRB2
SCHEMBL8017724 0.80 FABP4 (0.67) FABP4FABP3FABP5GABRA1GABRB2
SCHEMBL17311830 0.80 FABP3 (0.96) FABP4FABP3FABP5GABRA1GABRB2
SCHEMBL14519841 0.80 FABP4 (0.67) FABP4FABP3FABP5GABRA1GABRB2
SCHEMBL7484474 0.80 FABP4 (0.67) FABP4FABP3FABP5GABRA1GABRB2
SCHEMBL17311829 0.78 FABP4 (0.64) FABP4FABP3FABP5GABRA1GABRB2
SCHEMBL19245855 0.77 FABP3 (0.62) FABP4FABP3FABP5GABRA1GABRB2
SCHEMBL5997548 0.77 FABP4 (0.62) FABP4FABP3FABP5GABRA1GABRB2
SCHEMBL10167825 0.77 FABP3 (0.62) FABP4FABP3FABP5GABRA1GABRB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3303353-B1 PROCESS JOHNSON MATTHEY PLC (GB) 2022-01-12 EP disclosed
US-10428098-B2 Processes for preparing and using ruthenium and osmium complexes JOHNSON MATTHEY PUBLIC LIMITED COMPANY (GB) 2019-10-01 US disclosed
EP-2399895-B1 Process for producing optically active aliphatic fluoroalcohol KANTO KAGAKU (JP) 2018-08-08 EP disclosed
US-20180148465-A1 PROCESS UNIVERSITA DEGLI STUDI DI UDINE (IT) 2018-05-31 US disclosed
EP-3303353-A1 PROCESS Johnson Matthey Public Limited Company (GB) 2018-04-11 EP disclosed
CN-107690436-A Method of producing a composite material 庄信万丰股份有限公司 2018-02-13 CN disclosed
US-9617292-B2 Method for producing novel organometallic complex and amine compound KANTO KAGAKU KABUSHIKI KAISHA (JP) 2017-04-11 US disclosed
WO-2016193762-A1 PROCESS JOHNSON MATTHEY PUBLIC LIMITED COMPANY (GB) 2016-12-08 WO disclosed
US-20160060282-A1 METHOD FOR PRODUCING NOVEL ORGANOMETALLIC COMPLEX AND AMINE COMPOUND KANTO KAGAKU KABUSHIKI KAISHA (JP) 2016-03-03 US disclosed
EP-2990409-A1 METHOD FOR PRODUCING NOVEL ORGANOMETALLIC COMPLEX AND AMINE COMPOUND Kanto Kagaku Kabushiki Kaisha (JP) 2016-03-02 EP disclosed
US-20100069683-A1 Organic metal compound and process for preparing optically-active alcohols using the same KANTO KAGAKU KABUSHIKI KAISHA (JP) 2010-03-18 US disclosed
US-20090216019-A1 Process for Production of Optically Active Quinuclidinols KANTO KAGAKU KABUSHIKI KAISHA 2009-08-27 US disclosed
US-20090062573-A1 Organic metal compound and process for preparing optically-active alcohols using the same KANTO KAGAKU KABUSHIKI KAISHA (JP) 2009-03-05 US disclosed
US-7378560-B2 Ruthenium complex and process for producing tert-alkyl alcohol therewith KANTO KANGAKU KABUSHIKI KAISHA (JP) 2008-05-27 US disclosed
US-20080081911-A1 Method for producing optically active quinuclidinols having one or more substituted groups at the 2-position KANTO KAGAKU KABUSHIKI KAISHA (JP) 2008-04-03 US disclosed
EP-1867654-A1 PROCESS FOR PRODUCTION OF OPTICALLY ACTIVE QUINUCLIDINOL Nagoya Industrial Science Research Institute (JP) 2007-12-19 EP disclosed
US-20070265448-A1 Ruthenium Complex and Process for Producing Tert-Alkyl Alcohol Therewith KANTO KAGAKU KABUSHIKI KAISHA (JP) 2007-11-15 US disclosed
US-20070225528-A1 Process for Producing Optically Active Alcohol NAGOYA INDUSTRIAL SCIENCE RESEARCH CENTER (JP) 2007-09-27 US disclosed
EP-1813621-A1 RUTHENIUM COMPLEX AND PROCESS FOR PRODUCING TERT-ALKYL ALCOHOL THEREWITH Nagoya Industrial Science Research Institute (JP) 2007-08-01 EP disclosed
EP-1741693-A1 PROCESS FOR PRODUCTION OF OPTICALLY ACTIVE ALCOHOLS Nagoya Industrial Science Research Institute (JP) 2007-01-10 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (9 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090062573-A1 Organic metal compound and process for preparing optically-active alcohols using the same ADH1C, ADH1A, ADH5 FABP4 3689/4885FABP3 4355/4885FABP5 1907/4885
US-20080081911-A1 Method for producing optically active quinuclidinols having one or more substituted groups at the 2-position NQO1, SQLE, NQO2 FABP4 4859/4885FABP3 4349/4885FABP5 4298/4885
US-20070225528-A1 Process for Producing Optically Active Alcohol ADH1C, ADH1A, ADH5 FABP4 3743/4885FABP3 4252/4885FABP5 2213/4885
US-20070265448-A1 Ruthenium Complex and Process for Producing Tert-Alkyl Alcohol Therewith TERT, ADH1C, ADH1A FABP4 2819/4885FABP3 2698/4885FABP5 1276/4885
US-20090216019-A1 Process for Production of Optically Active Quinuclidinols NQO2, ADH7, MRPL21 FABP4 4279/4885FABP3 4173/4885FABP5 3459/4885
US-10428098-B2 Processes for preparing and using ruthenium and osmium complexes OSTC, OTC, ORC3 FABP4 2480/4885FABP3 3430/4885FABP5 771/4885
US-20180148465-A1 PROCESS OSTC, AP2S1, LGALS4 FABP4 1050/4885FABP3 2801/4885FABP5 195/4885
US-20100069683-A1 Organic metal compound and process for preparing optically-active alcohols using the same ADH1C, ADH1A, ADH5 FABP4 3689/4885FABP3 4355/4885FABP5 1907/4885
US-20160060282-A1 METHOD FOR PRODUCING NOVEL ORGANOMETALLIC COMPLEX AND AMINE COMPOUND GNMT, HNMT, CYP4F11 FABP4 4794/4885FABP3 4855/4885FABP5 4340/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.