SCHEMBL8077797

SCHEMBL8077797

C=CC(C)(O)CCC=C(C)CCC(=O)O

nearest known ligand 0.66

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 3/20 0.66
FNTA P49354 2/20 0.38
FNTB P49356 2/20 0.38
IMPDH2 P12268 11/20 0.36
MEN1 O00255 1/20 0.34
TRPA1 O75762 1/20 0.34
MAPT P10636 1/20 0.34
KMT2A Q03164 1/20 0.34

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
Nerolidol SCHEMBL31233868 0.88 ALOX15 (0.82) ALOX15FNTAFNTBMEN1TRPA1
Nerolidol SCHEMBL28601537 0.88 ALOX15 (0.82) ALOX15FNTAFNTBMEN1TRPA1
SCHEMBL1301538 0.85 ALOX15 (0.73) ALOX15MEN1MAPTKMT2A
SCHEMBL1301540 0.85 ALOX15 (0.73) ALOX15MEN1MAPTKMT2A
SCHEMBL9983327 0.85 ALOX15 (0.59) ALOX15MEN1KMT2A
Linalyl Acetate SCHEMBL1234147 0.84 ALOX15 (0.59) ALOX15FNTAFNTBMEN1TRPA1
Nerolidol SCHEMBL28012619 0.84 ALOX15 (0.88) ALOX15FNTAFNTBMEN1TRPA1
Acetic Acid SCHEMBL29232756 0.83 ALOX15 (0.61) ALOX15MEN1KMT2A
SCHEMBL17388700 0.83 ALOX15 (0.69) ALOX15FNTAFNTBKMT2A
SCHEMBL17388701 0.83 ALOX15 (0.69) ALOX15FNTAFNTBKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6146621-A Composition for reducing malodor impression on inanimate surfaces THE PROCTER & GAMBLE COMPANY (US) 2000-11-14 US disclosed
US-6103678-A POLYAMINES FOR FABRIC TREATMENT THE PROCTER & GAMBLE COMPANY (US) 2000-08-15 US disclosed
US-5939060-A USING CYCLODEXTRIN SOLUTION THE PROCTER & GAMBLE COMPANY (US) 1999-08-17 US disclosed