SCHEMBL7791076

SCHEMBL7791076

O=C1CCCCC=CCCCCCCCCCC1=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.42
▸ TRIM24 O15164 2/20 0.40
▸ TRIM33 Q9UPN9 2/20 0.40
▸ MAOA P21397 2/20 0.36
▸ MAOB P27338 2/20 0.36
▸ CYP2A6 P11509 1/20 0.36
▸ HDAC3 O15379 4/20 0.35
▸ HDAC4 P56524 4/20 0.35
▸ HDAC1 Q13547 4/20 0.35
▸ HDAC7 Q8WUI4 4/20 0.35
▸ HDAC2 Q92769 4/20 0.35
▸ HDAC10 Q969S8 4/20 0.35
▸ HDAC11 Q96DB2 4/20 0.35
▸ HDAC8 Q9BY41 4/20 0.35
▸ HDAC6 Q9UBN7 4/20 0.35
▸ HDAC9 Q9UKV0 4/20 0.35
▸ HDAC5 Q9UQL6 4/20 0.35
▸ CXCR3 P49682 1/20 0.32
▸ HIF1A Q16665 1/20 0.31
▸ MEN1 O00255 2/20 0.31

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
SCHEMBL28477188 1.00 ALDH1A1 (0.42) ALDH1A1TRIM24TRIM33MAOAMAOB
SCHEMBL7791080 1.00 ALDH1A1 (0.42) ALDH1A1TRIM24TRIM33MAOAMAOB
SCHEMBL28486373 1.00 ALDH1A1 (0.42) ALDH1A1TRIM24TRIM33MAOAMAOB
SCHEMBL28486375 1.00 ALDH1A1 (0.42) ALDH1A1TRIM24TRIM33MAOAMAOB
SCHEMBL7786773 1.00 ALDH1A1 (0.42) ALDH1A1TRIM24TRIM33MAOAMAOB
SCHEMBL28473730 1.00 ALDH1A1 (0.42) ALDH1A1TRIM24TRIM33MAOAMAOB
SCHEMBL28477921 1.00 ALDH1A1 (0.42) ALDH1A1TRIM24TRIM33MAOAMAOB
SCHEMBL31506480 1.00 ALDH1A1 (0.42) ALDH1A1TRIM24TRIM33MAOAMAOB
SCHEMBL7786769 1.00 ALDH1A1 (0.42) ALDH1A1TRIM24TRIM33MAOAMAOB
SCHEMBL28476856 1.00 ALDH1A1 (0.42) ALDH1A1TRIM24TRIM33MAOAMAOB

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
CN-115666267-A Spice composition and drink food 高砂香料工业株式会社 2023-01-31 — — CN disclosed
EP-0818452-B1 Preparation of cis-isoambrettolides and their use as a fragrance MANE V FILS SA (FR) 2001-10-24 — — EP disclosed
US-5786321-A Preparation of cis-isoambrettolidies and their use as a fragrance V. MANE FILS S.A. (FR) 1998-07-28 — — US disclosed
US-5726328-A Preparation of cis-isoambrettolides and their use as a fragrance V. MANE FILS S.A. (FR) 1998-03-10 — — US disclosed
EP-0818452-A2 Preparation of cis-isoambrettolides and their use as a fragrance V. Mane Fils S.A. (FR) 1998-01-14 — — EP disclosed
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