SCHEMBL442519

SCHEMBL442519

CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC(Cc1ccccc1)C(=O)OCC

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 8/20 0.49
PPARG P37231 3/20 0.49
MMP8 P22894 1/20 0.48
MEN1 O00255 1/20 0.46
NPC1 O15118 1/20 0.46
KMT2A Q03164 1/20 0.46
CYP1A2 P05177 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
PPARA Q07869 1/20 0.42
ALDH1A1 P00352 1/20 0.41
TP53 P04637 1/20 0.41
PIN1 Q13526 1/20 0.40
NPY1R P25929 1/20 0.40
NPY2R P49146 1/20 0.40
FAAH O00519 1/20 0.40
CNR1 P21554 1/20 0.40
CNR2 P34972 1/20 0.40
CPA1 P15085 1/20 0.40
CPA3 P15088 1/20 0.40

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
SCHEMBL4734008 0.85 CYP1A2 (0.58) EPHX2CYP1A2CPA1CPA3
SCHEMBL563663 0.82 PPARG (0.53) EPHX2PPARGMMP8MEN1NPC1
SCHEMBL10521821 0.82 MMP8 (0.61) EPHX2PPARGMMP8MEN1NPC1
SCHEMBL14207099 0.79 EPHX2 (0.40) EPHX2PPARGMMP8MEN1NPC1
SCHEMBL15479082 0.79 PPARG (0.58) EPHX2PPARGMMP8MEN1NPC1
SCHEMBL3504311 0.79 EPHX2 (0.70) EPHX2PPARGMMP8MEN1NPC1
SCHEMBL444331 0.79 ADORA3 (0.47) EPHX2PPARGMEN1NPC1KMT2A
SCHEMBL3696782 0.79 ADORA3 (0.47) EPHX2PPARGMEN1NPC1KMT2A
SCHEMBL3205323 0.79 ADORA3 (0.47) EPHX2PPARGMEN1NPC1KMT2A
SCHEMBL442023 0.79 ADORA3 (0.47) EPHX2PPARGMEN1NPC1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1888727-B1 NEW DHA DERIVATIVES AND THEIR USE AS MEDICAMENTS PRONOVA BIOPHARMA NORGE AS (NO) 2015-04-15 EP disclosed
US-20120065260-A1 NOVEL COMPOUNDS Pronova BioPhrma Norge AS 2012-03-15 US disclosed
US-20120065260-A1 NOVEL COMPOUNDS Pronova BioPhrma Norge AS 2012-03-15 US disclosed
US-8034842-B2 Compounds PRONOVA BIOPHARMA NORGE AS (NO) 2011-10-11 US disclosed
US-8034842-B2 Compounds PRONOVA BIOPHARMA NORGE AS (NO) 2011-10-11 US disclosed
US-7550613-B2 alpha-methoxy docosahexanoic acid ethyl ester, alpha-iodo-docosahexanoic acid ethyl ester; antidiabetic for diabetes type 2, cardiovascular disorders, obesity, amyloidosis, prophylaxis; free of 4,7,10,13,16,19-docosahexanoic acid ( DHA), alpha-methyl DHA, alpha-methyl DHA-methyl ester PRONOVA BIOPHARMA NORGE AS (NO) 2009-06-23 US disclosed
US-7550613-B2 alpha-methoxy docosahexanoic acid ethyl ester, alpha-iodo-docosahexanoic acid ethyl ester; antidiabetic for diabetes type 2, cardiovascular disorders, obesity, amyloidosis, prophylaxis; free of 4,7,10,13,16,19-docosahexanoic acid ( DHA), alpha-methyl DHA, alpha-methyl DHA-methyl ester PRONOVA BIOPHARMA NORGE AS (NO) 2009-06-23 US disclosed
US-20080300306-A1 Novel Compounds BRYHN MORTEN 2008-12-04 US disclosed
US-20080300306-A1 Novel Compounds BRYHN MORTEN 2008-12-04 US disclosed
US-20070088170-A1 Novel compounds PRONOVA BIOPHARMA NORGE AS (NO) 2007-04-19 US disclosed
US-20070088170-A1 Novel compounds PRONOVA BIOPHARMA NORGE AS (NO) 2007-04-19 US 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-20070088170-A1 Novel compounds FFAR2, GPR119, ALOX12 EPHX2 281/4885PPARG 104/4885MMP8 3230/4885
US-20080300306-A1 Novel Compounds GPR119, FFAR2, ALOX12 EPHX2 287/4885PPARG 118/4885MMP8 3125/4885
US-20120065260-A1 NOVEL COMPOUNDS FFAR2, GPR119, ALOX12 EPHX2 281/4885PPARG 104/4885MMP8 3230/4885

“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.