SCHEMBL367155

SCHEMBL367155

CC(C#CO)c1cccc2ccccc12

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.47
CYP1A2 P05177 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
ADRA2A P08913 5/20 0.41
ADRA2B P18089 5/20 0.41
ADRA2C P18825 5/20 0.41
ADRA1A P35348 3/20 0.41
ADRA1D P25100 2/20 0.41
ADRA1B P35368 2/20 0.41
LMNA P02545 1/20 0.39
GAA P10253 1/20 0.39
LTC4S Q16873 1/20 0.38
SLC6A4 P31645 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
SCHEMBL27450400 0.83 ALDH1A1 (0.48) ALDH1A1CYP1A2CYP2C9CYP2C19ADRA2A
SCHEMBL2132070 0.77 ALDH1A1 (0.43) ALDH1A1CYP1A2CYP2C9CYP2C19ADRA2A
SCHEMBL10399086 0.77 ALDH1A1 (0.50) ALDH1A1CYP1A2CYP2C9CYP2C19ADRA2A
SCHEMBL143456 0.77 ALDH1A1 (0.50) ALDH1A1CYP1A2CYP2C9CYP2C19ADRA2A
SCHEMBL1306447 0.77 ALDH1A1 (0.50) ALDH1A1CYP1A2CYP2C9CYP2C19ADRA2A
SCHEMBL1155486 0.74 CYP1A2 (0.56) ALDH1A1CYP1A2CYP2C9CYP2C19ADRA2A
SCHEMBL1154786 0.74 CYP1A2 (0.56) ALDH1A1CYP1A2CYP2C9CYP2C19ADRA2A
SCHEMBL12200321 0.74 CYP1A2 (0.56) ALDH1A1CYP1A2CYP2C9CYP2C19ADRA2A
SCHEMBL110315 0.74 CYP1A2 (0.56) ALDH1A1CYP1A2CYP2C9CYP2C19ADRA2A
SCHEMBL31087888 0.74 CYP1A2 (0.56) ALDH1A1CYP1A2CYP2C9CYP2C19ADRA2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140241940-A1 METHOD FOR INHIBITING FOULING IN VAPOR TRANSPORT SYSTEM BAKER HUGHES INCORPORATED (US) 2014-08-28 US claimed
EP-2593583-A2 METHOD FOR INHIBITING FOULING IN VAPOR TRANSPORT SYSTEM Baker Hughes Incorporated (US) 2013-05-22 EP claimed
WO-2012009157-A2 METHOD FOR INHIBITING FOULING IN VAPOR TRANSPORT SYSTEM BAKER HUGHES INCORPORATED (US) 2012-01-19 WO claimed
US-20120012792-A1 METHOD FOR INHIBITING FOULING IN VAPOR TRANSPORT SYSTEM BAKER HUGHES INCORPORATED (US) 2012-01-19 US claimed
EP-0192130-B1 CORROSION INHIBITOR COMPOSITION HENKEL CORPORATION (a Delaware corp.) (US) 1990-06-27 EP claimed
US-10059872-B2 Corrosion inhibitor compositions for acidizing treatments LONZA INC. (US) 2018-08-28 US disclosed
EP-3237573-A1 CORROSION INHIBITOR COMPOSITIONS FOR ACIDIZING TREATMENTS Lonza Inc. (US) 2017-11-01 EP disclosed
CN-107207954-A Corrosion inhibitor composition for acidification 伦萨公司 2017-09-26 CN disclosed
WO-2016105996-A1 CORROSION INHIBITOR COMPOSITIONS FOR ACIDIZING TREATMENTS LONZA INC. (US) 2016-06-30 WO disclosed
US-20160177170-A1 Corrosion Inhibitor Compositions For Acidizing Treatments Arxada, LLC 2016-06-23 US disclosed
US-20140241940-A1 METHOD FOR INHIBITING FOULING IN VAPOR TRANSPORT SYSTEM BAKER HUGHES INCORPORATED (US) 2014-08-28 US disclosed
US-8734635-B2 Method for inhibiting fouling in vapor transport system BAKER HUGHES INCORPORATED (US) 2014-05-27 US disclosed
US-4248796-A CORROSION INHIBITORS FOR METALS PETROLITE CORPORATION (US) 1981-02-03 US disclosed
US-4206233-A Microbiocidal quaternaries of halogen derivatives of alkynoxymethyl amines PETROLITE CORPORATION (US) 1980-06-03 US disclosed
US-4187277-A Process of inhibiting corrosion with quaternaries of halogen derivatives of alkynoxymethyl amines PETROLITE CORPORATION (US) 1980-02-05 US disclosed
US-4120654-A Alkynoxymethyl amines as corrosion inhibitors PETROLITE CORPORATION (US) 1978-10-17 US disclosed
US-4101674-A Halogen derivatives of alkynoxymethyl amines as microbiocides PETROLITE CORPORATION (US) 1978-07-18 US disclosed
US-4065260-A Halogen derivatives of alkynoxymethyl amines as corrosion inhibitors PETROLITE CORPORATION (US) 1977-12-27 US disclosed
US-4026946-A CORROSION INHIBITORS PETROLITE CORPORATION (US) 1977-05-31 US disclosed
US-4026807-A CORROSION INHIBITORS PETROLITE CORPORATION (US) 1977-05-31 US disclosed