SCHEMBL6567589

SCHEMBL6567589

CC(C)=CCCC(C)=CCOC(=O)CCC(=O)OC=C(C)CCC=C(C)C

nearest known ligand 0.63

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.63
ALOX15 P16050 1/20 0.63
TRPV1 Q8NER1 3/20 0.57
FNTA P49354 2/20 0.49
FNTB P49356 2/20 0.49
PGGT1B P53609 1/20 0.49

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
SCHEMBL6567588 1.00 ALDH1A1 (0.63) ALDH1A1ALOX15TRPV1FNTAFNTB
SCHEMBL6021942 0.90 ALDH1A1 (0.76) ALDH1A1ALOX15TRPV1FNTAFNTB
SCHEMBL22833273 0.90 ALDH1A1 (0.76) ALDH1A1ALOX15TRPV1FNTAFNTB
SCHEMBL31171145 0.90 ALDH1A1 (0.76) ALDH1A1ALOX15TRPV1FNTAFNTB
SCHEMBL31171136 0.90 ALDH1A1 (0.76) ALDH1A1ALOX15TRPV1FNTAFNTB
SCHEMBL27735904 0.89 ALDH1A1 (0.73) ALDH1A1ALOX15TRPV1FNTAFNTB
SCHEMBL14273812 0.89 ALDH1A1 (0.73) ALDH1A1ALOX15TRPV1FNTAFNTB
SCHEMBL6743833 0.89 ALDH1A1 (0.73) ALDH1A1ALOX15TRPV1FNTAFNTB
SCHEMBL7907073 0.88 KDM4E (0.52) ALDH1A1ALOX15FNTAFNTB
SCHEMBL7907074 0.88 KDM4E (0.52) ALDH1A1ALOX15FNTAFNTB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0887336-B1 Precursor compounds GIVAUDAN SA (CH) 2004-01-07 EP claimed
US-6207857-B1 FOR ORGANOLEPTIC AND ANTIMICROBIAL COMPOUNDS GENERATED IN THE PRESENCE OF SKIN BACTERIA, ENZYMES OR ACIDIC OR ALKALINE CONDITIONS GIVAUDAN-ROURE (INTERNATIONAL) S.A. (CH) 2001-03-27 US claimed
EP-0887336-B1 Precursor compounds GIVAUDAN SA (CH) 2004-01-07 EP disclosed
US-6207857-B1 FOR ORGANOLEPTIC AND ANTIMICROBIAL COMPOUNDS GENERATED IN THE PRESENCE OF SKIN BACTERIA, ENZYMES OR ACIDIC OR ALKALINE CONDITIONS GIVAUDAN-ROURE (INTERNATIONAL) S.A. (CH) 2001-03-27 US disclosed
EP-0887336-A1 Precursor Compounds GIVAUDAN-ROURE (INTERNATIONAL) SA (CH) 1998-12-30 EP disclosed