SCHEMBL6923085

SCHEMBL6923085

CCCCCC=CCC=CC/C=C\CCCCCOCC(=O)O

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.69
ALDH1A1 P00352 5/20 0.63
PPARG P37231 5/20 0.63
F7 P08709 4/20 0.63
F3 P13726 4/20 0.63
PPARD Q03181 4/20 0.63
PPARA Q07869 4/20 0.63
FFAR1 O14842 3/20 0.63
KDM4E B2RXH2 2/20 0.63
LMNA P02545 2/20 0.63
CYP3A4 P08684 2/20 0.63
CYP19A1 P11511 2/20 0.63
FABP4 P15090 2/20 0.63
HPGD P15428 2/20 0.63
ALOX15 P16050 2/20 0.63
PTGS1 P23219 2/20 0.63
AKR1C3 P42330 2/20 0.63
NR4A2 P43354 2/20 0.63
HSD17B10 Q99714 2/20 0.63
TDP1 Q9NUW8 2/20 0.63

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
SCHEMBL6293227 1.00 EPHX2 (0.69) EPHX2ALDH1A1PPARGF7F3
SCHEMBL6293226 1.00 EPHX2 (0.69) EPHX2ALDH1A1PPARGF7F3
SCHEMBL7716340 0.98 EPHX2 (0.71) EPHX2ALDH1A1PPARGF7F3
SCHEMBL6928120 0.98 EPHX2 (0.71) EPHX2ALDH1A1PPARGF7F3
SCHEMBL1627821 0.92 EPHX2 (0.71) EPHX2PPARGF7F3PPARD
SCHEMBL1602949 0.92 EPHX2 (0.62) EPHX2ALDH1A1PPARGF7F3
SCHEMBL1602954 0.92 EPHX2 (0.62) EPHX2ALDH1A1PPARGF7F3
SCHEMBL1627823 0.92 EPHX2 (0.71) EPHX2PPARGF7F3PPARD
SCHEMBL1627678 0.92 EPHX2 (0.71) EPHX2PPARGF7F3PPARD
SCHEMBL1627680 0.92 EPHX2 (0.71) EPHX2PPARGF7F3PPARD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0904072-A4 METHODS OF TREATING IMMUNOPATHOLOGIES USING POLYUNSATURATED FATTYACIDS PEPTIDE TECHNOLOGY PTY LTD (AU) 2003-07-30 EP disclosed
US-6262119-B1 ADMINISTERING POLYUNSATURATED FATTY ACID CONTAINING 18-25 CARBONS, 1-6 DOUBLE BONDS AND HAS ONE OR TWO SUBSTITUTIONS FOR THERAPY OF T-CELL MEDIATED DISEASES SUCH AS DIABETES, MULTIPLE SCLEROSIS, RHEUMATOID ARTHRITIS, HERPES SIMPLEX ETC. PEPTIDE TECHNOLOGY LIMITED (AU) 2001-07-17 US disclosed
EP-0904072-A1 METHODS OF TREATING IMMUNOPATHOLOGIES USING POLYUNSATURATED FATTYACIDS Peptide Technology Pty. Ltd. (AU) 1999-03-31 EP disclosed
WO-1997038688-A1 METHODS OF TREATING IMMUNOPATHOLOGIES USING POLYUNSATURATED FATTYACIDS PEPTIDE TECHNOLOGY PTY. LIMITED (AU) 1997-10-23 WO disclosed