SCHEMBL7499542

SCHEMBL7499542

CCC=CCCC(C)C=O

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 1/20 0.35
ALDH1A1 P00352 7/20 0.34
MAPT P10636 4/20 0.34
CYP19A1 P11511 4/20 0.34
PPARG P37231 3/20 0.34
OXER1 Q8TDS5 3/20 0.34
RXRA P19793 2/20 0.34
FFAR1 O14842 2/20 0.34
F7 P08709 3/20 0.32
F3 P13726 3/20 0.32
PPARA Q07869 3/20 0.32
PTGS1 P23219 2/20 0.32
KMT2A Q03164 2/20 0.32
PPARD Q03181 2/20 0.32
ADORA3 P0DMS8 1/20 0.32
TDP1 Q9NUW8 2/20 0.31
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
NR1I2 O75469 1/20 0.31
LMNA P02545 1/20 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
SCHEMBL7499539 1.00 TRPA1 (0.35) TRPA1ALDH1A1MAPTCYP19A1PPARG
SCHEMBL29665966 0.86 ALDH1A1 (0.38) ALDH1A1
SCHEMBL18828262 0.78
SCHEMBL7254400 0.78
SCHEMBL7254401 0.78
SCHEMBL835461 0.76 ALDH1A1 (0.30) ALDH1A1MAPTCYP19A1PPARGOXER1
SCHEMBL1358451 0.76 ALDH1A1 (0.30) ALDH1A1MAPTCYP19A1PPARGOXER1
SCHEMBL9441638 0.75
SCHEMBL7619742 0.75
SCHEMBL15968671 0.74 ALDH1A1 (0.33) TRPA1ALDH1A1MAPTCYP19A1PPARG

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 42 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116867885-A Improvements in or relating to organic compounds 奇华顿股份有限公司 2023-10-10 CN claimed
CN-115551986-A Fragrance composition 奇华顿股份有限公司 2022-12-30 CN claimed
CN-109689848-B Fragrance composition 奇华顿股份有限公司 2022-12-23 CN claimed
CN-110099993-B High impact perfume microcapsules of balanced density 弗门尼舍有限公司 2021-08-24 CN claimed
CN-118369306-A Enol ether pro-fragrances 弗门尼舍有限公司 2024-07-19 CN disclosed
CN-117999057-A Improved perfume compositions comprising sulfur-containing fragrance precursor compounds 弗门尼舍有限公司 2024-05-07 CN disclosed
CN-116867885-A Improvements in or relating to organic compounds 奇华顿股份有限公司 2023-10-10 CN disclosed
CN-116547258-A Method for inducing conversion of volatile terpene materials 奇华顿股份有限公司 2023-08-04 CN disclosed
CN-116368115-A Method for reducing conversion of volatile terpene materials 奇华顿股份有限公司 2023-06-30 CN disclosed
CN-115702138-A Enol ether pro-fragrances 弗门尼舍有限公司 2023-02-14 CN disclosed
CN-115551630-A Hybrid microcapsules comprising regenerated biopolymers 弗门尼舍有限公司 2022-12-30 CN disclosed
CN-115551986-A Fragrance composition 奇华顿股份有限公司 2022-12-30 CN disclosed
WO-2001053241-A1 CHEMICAL TRANSFORMATION OF SUBSTRATES USING NONMETALLIC, ORGANIC CATALYST COMPOSITIONS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2001-07-26 WO disclosed
WO-2001053269-A1 ACID ADDITION SALTS OF IMIDAZOLIDINONES AS REACTION CATALYSTS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2001-07-26 WO disclosed
EP-1029032-A1 LAUNDRY TREATMENT PRODUCTS FOR SPANDEX CONTAINING FABRICS UNILEVER PLC (GB) 2000-08-23 EP disclosed
EP-1023480-A1 METHOD FOR TEXTILE TREATMENT FOR SPANDEX CONTAINING FABRICS E.I. DUPONT DE NEMOURS AND COMPANY (US) 2000-08-02 EP disclosed
EP-1021160-A1 PERFUME COMPOSITIONS QUEST INTERNATIONAL NEDERLAND BV (NL) 2000-07-26 EP disclosed
WO-1999019553-A1 METHOD FOR TEXTILE TREATMENT FOR SPANDEX CONTAINING FABRICS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1999-04-22 WO disclosed
WO-1999018926-A1 PERFUME COMPOSITIONS QUEST INTERNATIONAL B.V. (NL) 1999-04-22 WO disclosed
WO-1999019452-A1 LAUNDRY TREATMENT PRODUCTS FOR SPANDEX® CONTAINING FABRICS UNILEVER PLC (GB) 1999-04-22 WO disclosed