SCHEMBL2024342

SCHEMBL2024342

CCCCCCCCCCCCCCCCCCCCC(C(=O)O)c1cccc2ccccc12

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.49
KMT2A Q03164 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
CNR2 P34972 6/20 0.43
CNR1 P21554 4/20 0.43
ALOX5 P09917 1/20 0.43
CYSLTR2 Q9NS75 1/20 0.42
CYSLTR1 Q9Y271 1/20 0.42
CYP2C9 P11712 1/20 0.42
HPGD P15428 1/20 0.42
CYP2C19 P33261 1/20 0.42
HTT P42858 1/20 0.42
EPHX2 P34913 2/20 0.41
TACR3 P29371 1/20 0.41

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
SCHEMBL1826965 1.00 KDM4E (0.49) KDM4EKMT2AL3MBTL1CNR2CNR1
SCHEMBL2028355 1.00 KDM4E (0.49) KDM4EKMT2AL3MBTL1CNR2CNR1
SCHEMBL3740930 1.00 KDM4E (0.49) KDM4EKMT2AL3MBTL1CNR2CNR1
SCHEMBL5357939 1.00 KDM4E (0.49) KDM4EKMT2AL3MBTL1CNR2CNR1
SCHEMBL8015861 1.00 KDM4E (0.49) KDM4EKMT2AL3MBTL1CNR2CNR1
SCHEMBL2536987 1.00 KDM4E (0.49) KDM4EKMT2AL3MBTL1CNR2CNR1
SCHEMBL451183 1.00 KDM4E (0.49) KDM4EKMT2AL3MBTL1CNR2CNR1
SCHEMBL5156697 0.99 KDM4E (0.47) KDM4EKMT2AL3MBTL1CNR2CNR1
SCHEMBL6842064 0.94 ALOX5 (0.44) KDM4EKMT2AL3MBTL1ALOX5CYP2C9
SCHEMBL5351493 0.92 FAAH (0.45) KDM4EKMT2AL3MBTL1CNR2CNR1

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-106726638-A The reversed-phase emulsion of the ester oil containing alkoxylate 禾大国际股份公开有限公司 2017-05-31 CN disclosed
EP-2515833-B1 INVERSE EMULSIONS COMPRISING AN ALKOXYLATED ESTER OIL CRODA INT PLC (GB) 2015-11-25 EP disclosed
US-9044622-B2 Inverse emulsions comprising an alkoxylated ester oil CRODA INTERNATIONAL PLC (GB) 2015-06-02 US disclosed
EP-1435978-B1 ESTERS OF AROMATIC ALKOXYLATED ALCOHOLS AND FATTY CARBOXYLIC ACIDS CRODA INC (US) 2014-09-03 EP disclosed
US-20120288464-A1 Inverse Emulsions Comprising an Alkoxylated Ester Oil CRODA INTERNATIONAL PLC (GB) 2012-11-15 US disclosed
EP-2515833-A1 INVERSE EMULSIONS COMPRISING AN ALKOXYLATED ESTER OIL Croda International PLC (GB) 2012-10-31 EP disclosed
WO-2011077083-A1 INVERSE EMULSIONS COMPRISING AN ALKOXYLATED ESTER OIL CRODA INTERNATIONAL PLC (GB) 2011-06-30 WO disclosed
US-7217424-B2 Compositions containing esters of aromatic alkoxylated alcohols and fatty carboxylic acids CRODA, INC. (US) 2007-05-15 US disclosed
EP-1435978-A4 ESTERS OF AROMATIC ALKOXYLATED ALCOHOLS AND FATTY CARBOXYLIC ACIDS CRODA INC (US) 2006-05-17 EP disclosed
US-6987195-B2 Esters of aromatic alkoxylated alcohols and fatty carboxylic acids CRODA, INC. (US) 2006-01-17 US disclosed
EP-1435978-A2 ESTERS OF AROMATIC ALKOXYLATED ALCOHOLS AND FATTY CARBOXYLIC ACIDS Croda, Inc. (US) 2004-07-14 EP disclosed
US-20030181744-A1 Esters of aromatic alkoxylated alcohols and fatty carboxylic acids CRODA, INC. 2003-09-25 US disclosed
US-20030161792-A1 Compositions containing esters of aromatic alkoxylated alcohols and fatty carboxylic acids CRODA, INC. 2003-08-28 US disclosed
WO-2003032919-A2 ESTERS OF AROMATIC ALKOXYLATED ALCOHOLS AND FATTY CARBOXYLIC ACIDS CRODA, INC. (US) 2003-04-24 WO 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 (3 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-20030161792-A1 Compositions containing esters of aromatic alkoxylated alcohols and fatty carboxylic acids AHR, ARNT, TYR KDM4E 364/4885KMT2A 3069/4885L3MBTL1 3887/4885
US-20120288464-A1 Inverse Emulsions Comprising an Alkoxylated Ester Oil ALK, POLQ, EBP KDM4E 3615/4885KMT2A 3864/4885L3MBTL1 1718/4885
US-20030181744-A1 Esters of aromatic alkoxylated alcohols and fatty carboxylic acids FABP4, CUTA, ALK KDM4E 1562/4885KMT2A 3307/4885L3MBTL1 4246/4885

“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.