SCHEMBL1782873

SCHEMBL1782873

CCCCCC(C)C(C)=O

nearest known ligand 0.64

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.64
ACE2 Q9BYF1 1/20 0.52
FDPS P14324 4/20 0.48
FAAH O00519 1/20 0.47
FFAR1 O14842 2/20 0.47
FFAR4 Q5NUL3 1/20 0.47
GPR84 Q9NQS5 3/20 0.46
SPHK1 Q9NYA1 1/20 0.46
NFKB1 P19838 1/20 0.45
MAPT P10636 1/20 0.45
TP53 P04637 1/20 0.45
LCK P06239 1/20 0.45
PPARD Q03181 1/20 0.45
ZDHHC20 Q5W0Z9 1/20 0.45
ZDHHC2 Q9UIJ5 1/20 0.45

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
SCHEMBL6919256 1.00 CA1 (0.64) CA1ACE2FDPSFAAHFFAR1
SCHEMBL8064226 1.00 CA1 (0.64) CA1ACE2FDPSFAAHFFAR1
SCHEMBL574092 0.98 CA1 (0.61) CA1ACE2FDPSFAAHFFAR1
SCHEMBL7912103 0.98 CA1 (0.61) CA1ACE2FDPSFAAHFFAR1
SCHEMBL8513608 0.98 CA1 (0.61) CA1ACE2FDPSFAAHFFAR1
SCHEMBL13819793 0.98 CA1 (0.61) CA1ACE2FDPSFAAHFFAR1
SCHEMBL2573740 0.98 CA1 (0.61) CA1ACE2FDPSFAAHFFAR1
SCHEMBL11386622 0.98 CA1 (0.61) CA1ACE2FDPSFAAHFFAR1
SCHEMBL13819794 0.98 CA1 (0.61) CA1ACE2FDPSFAAHFFAR1
SCHEMBL13538692 0.98 CA1 (0.61) CA1ACE2FDPSFAAHFFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111936144-B JAK inhibitors 廖细斌 2023-12-22 CN claimed
CN-111819176-B 4-azaindole compounds 百时美施贵宝公司 2023-12-15 CN claimed
CN-113912556-B Synthesis method of alpha, beta-dicarbonyl-1, 2, 3-triazole compound 武汉工程大学 2023-06-09 CN claimed
CN-113912556-A Synthetic method of alpha, beta-dicarbonyl-1, 2, 3-triazole compound 武汉工程大学 2022-01-11 CN claimed
CN-111936144-A JAK inhibitors 廖细斌 2020-11-13 CN claimed
CN-107923120-A Composition for reducing malodour and use thereof 阿吉莱克斯香料和香水公司 2018-04-17 CN claimed
CN-107001995-A Cleaning and/or treatment compositions comprising malodor reduction composition 宝洁公司 2017-08-01 CN claimed
CN-103958047-B Microcapsules and their use 弗门尼舍有限公司 2017-03-01 CN claimed
EP-2931235-A1 ANTIPERSPIRANT AND DEODORANT COMPOSITIONS The Procter & Gamble Company (US) 2015-10-21 EP claimed
EP-2931238-A2 ANTIPERSPIRANT AND DEODORANT COMPOSITIONS The Procter & Gamble Company (US) 2015-10-21 EP claimed
WO-2014093748-A1 ANTIPERSPIRANT AND DEODORANT COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 2014-06-19 WO claimed
WO-2014093828-A2 ANTIPERSPIRANT AND DEODORANT COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 2014-06-19 WO claimed
WO-2009131692-A1 SUBSTRATES FOR DELIVERY OF PHYSIOLOGICALLY ACTIVE AGENTS THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ALABAMA (US) 2009-10-29 WO claimed
EP-3792241-B1 METHOD FOR CONVERTING HYDROXYL GROUP OF ALCOHOL TAKASAGO PERFUMERY CO LTD (JP) 2026-04-22 EP disclosed
EP-4653479-A1 ETHYLENE/ALPHA-OLEFIN COPOLYMER FOR SOLAR CELL ENCAPSULATION ADHESIVE FILM, AND USE THEREOF Wanhua Chemical Group Co., Ltd. (CN) 2025-11-26 EP disclosed
WO-2025082301-A1 ETHYLENE/α-OLEFIN COPOLYMER FOR SOLAR CELL ENCAPSULATION ADHESIVE FILM, AND USE THEREOF 万华化学集团股份有限公司 2025-04-24 WO disclosed
EP-0350069-B1 METHOD FOR OXIDIZING UNSATURATED AROMATIC COMPOUNDS NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1993-03-17 EP disclosed
EP-0403170-A2 Photoimageable compositions MORTON INTERNATIONAL, INC. (US) 1990-12-19 EP disclosed
US-4967009-A REACTING UNSATURATED AROMATIC COMPOUNDS WITH AROMATIC IODOSYL COMPOUNDS TO YIELD AROMATIC ALDEHYDES OR KETONES NIPPON PETROCHEMICALS CO., LTD. (JP) 1990-10-30 US disclosed
EP-0350069-A2 Method for oxidizing unsaturated aromatic compounds NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1990-01-10 EP disclosed