SCHEMBL30358271

SCHEMBL30358271

CCC(=O)/C(C)=C/C1=C(C)CCCC1(C)C

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.51
HAO1 Q9UJM8 1/20 0.51
RARA P10276 6/20 0.45
RARB P10826 6/20 0.45
RARG P13631 6/20 0.45
ALDH1A1 P00352 9/20 0.44
RXRA P19793 6/20 0.44
MAPT P10636 6/20 0.44
CYP3A4 P08684 5/20 0.44
PTGS1 P23219 4/20 0.44
RXRB P28702 3/20 0.44
RXRG P48443 3/20 0.44
RORC P51449 2/20 0.44
ADORA3 P0DMS8 2/20 0.44
MAPK1 P28482 2/20 0.44
HTR2B P41595 2/20 0.44
BLM P54132 2/20 0.44
HIF1A Q16665 2/20 0.44
DRD3 P35462 2/20 0.44
LMNA P02545 2/20 0.44

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
SCHEMBL1472109 0.84 CYP1A2 (0.57) CYP1A2HAO1RARARARBRARG
SCHEMBL3307322 0.84 CYP1A2 (0.57) CYP1A2HAO1RARARARBRARG
SCHEMBL1472108 0.84 CYP1A2 (0.57) CYP1A2HAO1RARARARBRARG
SCHEMBL14430255 0.82 CYP1A2 (0.51) CYP1A2HAO1RARARARBRARG
SCHEMBL5435696 0.79 CYP1A2 (0.51) CYP1A2HAO1RARARARBRARG
SCHEMBL8474784 0.79 CYP1A2 (0.55) CYP1A2HAO1RARARARBRARG
SCHEMBL5435690 0.79 CYP1A2 (0.51) CYP1A2HAO1RARARARBRARG
SCHEMBL8469731 0.74 HAO1 (0.47) CYP1A2HAO1RARARARBRARG
SCHEMBL1404273 0.74 HAO1 (0.72) CYP1A2HAO1RARARARBRARG
SCHEMBL2130233 0.74 HAO1 (0.72) CYP1A2HAO1RARARARBRARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117396590-A Perfume for improving relaxation state and evaluation method 奇华顿股份有限公司 2024-01-12 CN claimed
CN-117069572-A Method for improving separation yield of pseudo-isomethyl ionone 万华化学集团股份有限公司 2023-11-17 CN claimed
CN-119118811-B Preparation method of pseudo-methyl ionone 滕州鑫和生物科技有限公司 2025-05-02 CN disclosed
CN-119875740-A Essence composition capable of replacing new convallaria and preparation method and application thereof 广州市诚馨香料科技有限公司 2025-04-25 CN disclosed
CN-119219480-A Isomethylionone and preparation method thereof 万华化学集团股份有限公司 2024-12-31 CN disclosed
CN-119118811-A Preparation method of pseudo-methyl ionone 滕州鑫和生物科技有限公司 2024-12-13 CN disclosed
US-20240410055-A1 METHOD AND FORMULATION FOR PREPARING OPTICAL METAL OXIDE LAYERS MERCK PATENT GMBH (DE) 2024-12-12 US disclosed
CN-118076767-A Method and formulation for producing an optical metal oxide layer 默克专利有限公司 2024-05-24 CN disclosed
CN-117988112-A Washable three-proofing breathable anti-drilling fabric easy to decontaminate and preparation method 江苏康乃馨羽绒制品科技有限公司 2024-05-07 CN disclosed
CN-117500783-A Perfume compounds 奇华顿股份有限公司 2024-02-02 CN disclosed
CN-117396590-A Perfume for improving relaxation state and evaluation method 奇华顿股份有限公司 2024-01-12 CN disclosed
CN-117069572-A Method for improving separation yield of pseudo-isomethyl ionone 万华化学集团股份有限公司 2023-11-17 CN disclosed
CN-116410080-A Method for recovering potassium acetate from waste brine in production of isopropyl ionone 万华化学集团股份有限公司 2023-07-11 CN disclosed
CN-116217367-A Preparation method of pseudo-isomethyl ionone 万华化学集团股份有限公司 2023-06-06 CN disclosed
WO-2023057401-A1 METHOD AND FORMULATION FOR PREPARING OPTICAL METAL OXIDE LAYERS MERCK PATENT GMBH (DE) 2023-04-13 WO disclosed