SCHEMBL6215733

SCHEMBL6215733

C=CCCC=C(C)C(C)=O

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.35
TSHR P16473 2/20 0.33
MAPT P10636 2/20 0.33
LMNA P02545 2/20 0.33
ABCC4 O15439 1/20 0.33
LSS P48449 1/20 0.32
USP2 O75604 1/20 0.30
CYP3A4 P08684 1/20 0.30
RECQL P46063 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL11039104 1.00 ALDH1A1 (0.35) ALDH1A1TSHRMAPTLMNAABCC4
SCHEMBL11739991 0.83 CD81 (0.39) ALDH1A1TSHRMAPTLMNAABCC4
SCHEMBL1802991 0.83 CD81 (0.39) ALDH1A1TSHRMAPTLMNAABCC4
SCHEMBL11037826 0.79 ALDH1A1 (0.36) ALDH1A1TSHRMAPTLMNAABCC4
SCHEMBL11037828 0.79 ALDH1A1 (0.36) ALDH1A1TSHRMAPTLMNAABCC4
SCHEMBL27867664 0.78 ALDH1A1 (0.41) ALDH1A1MAPTLMNAUSP2CYP3A4
SCHEMBL11039756 0.75 ALDH1A1 (0.36) ALDH1A1TSHRMAPTLMNAABCC4
SCHEMBL11039754 0.75 ALDH1A1 (0.36) ALDH1A1TSHRMAPTLMNAABCC4
SCHEMBL6752710 0.74
SCHEMBL6752709 0.74

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110200307-B Agilawood health-care cigarette and preparation method thereof 赣州市七道皇香药生物科技有限公司 2021-07-06 CN disclosed
CN-110200307-A A kind of health care agilawood cigarette and preparation method thereof 赣州市七道皇文化发展有限公司 2019-09-06 CN disclosed
CN-109294839-A A kind of natural perfume material health liquor and preparation method thereof 赣州市七道皇文化发展有限公司 2019-02-01 CN disclosed
CN-109259013-A A kind of pure natural spice beverage and preparation method thereof 赣州市七道皇文化发展有限公司 2019-01-25 CN disclosed
CN-108670912-A A kind of preparation method of pure natural spice Essence 赣州市七道皇文化发展有限公司 2018-10-19 CN disclosed
CN-101595137-B Polymer production at supercritical conditions EXXONMOBIL CHEM PATENTS INC 2012-03-28 CN disclosed
CN-101218282-B Aldehyde functional siloxanes DOW CORNING INC 2012-03-28 CN disclosed
EP-1509302-A1 SOLID MYCOCTOXIN CARRIERS Austria Wirtschaftsservice Gesellschaft mit beschränkter Haftung (AT) 2005-03-02 EP disclosed
WO-2003101580-A1 SOLID MYCOCTOXIN CARRIERS Austria Wirtschaftsservice Gesellschaft mit beschränkter Haftung (AT) 2003-12-11 WO disclosed
EP-0038471-B1 BETA-GAMMA-UNSATURATED KETONES AND ISOPRENOIC DIENONES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS PERFUME COMPOUNDS AND FLAVOURINGS Consortium für elektrochemische Industrie GmbH (DE) 1984-11-14 EP disclosed
US-4385185-A β-γ-Unsaturated ketones and isoprenoid 2,6 diones, a process for producing the same and their use as fragrant and flavoring substances CONSORTIUM FUR ELEKTROCHEMISCHE INDUSTRIE GMBH (DE) 1983-05-24 US disclosed
EP-0038471-A1 Beta-gamma-unsaturated ketones and isoprenoic dienones, process for their preparation and their use as perfume compounds and flavourings Consortium für elektrochemische Industrie GmbH (DE) 1981-10-28 EP disclosed