SCHEMBL2047273

SCHEMBL2047273

CCCCCC=C1CCCCC1=O

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CCR6 P51684 1/20 0.40
RAB9A P51151 2/20 0.38
NPC1 O15118 1/20 0.38
MAPT P10636 1/20 0.38
HPGD P15428 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
NFKB1 P19838 1/20 0.38
NFKB2 Q00653 1/20 0.38
RELA Q04206 1/20 0.38
PRKCA P17252 8/20 0.37
FAAH O00519 1/20 0.37
MGLL Q99685 1/20 0.37
TSHR P16473 1/20 0.35
KDM4E B2RXH2 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35

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
SCHEMBL4218362 1.00 CCR6 (0.40) CCR6RAB9ANPC1MAPTHPGD
SCHEMBL10938177 1.00 CCR6 (0.40) CCR6RAB9ANPC1MAPTHPGD
SCHEMBL440372 0.96 PRKCA (0.40) CCR6RAB9ANFKB1NFKB2RELA
SCHEMBL20608590 0.96 PRKCA (0.40) CCR6RAB9ANFKB1NFKB2RELA
SCHEMBL440371 0.96 PRKCA (0.40) CCR6RAB9ANFKB1NFKB2RELA
SCHEMBL812328 0.94 PRKCA (0.42) CCR6NFKB1NFKB2RELAPRKCA
SCHEMBL6902252 0.94 PRKCA (0.42) CCR6NFKB1NFKB2RELAPRKCA
SCHEMBL809687 0.94 PRKCA (0.42) CCR6NFKB1NFKB2RELAPRKCA
SCHEMBL812763 0.94 PRKCA (0.42) CCR6NFKB1NFKB2RELAPRKCA
SCHEMBL6897541 0.94 PRKCA (0.42) CCR6NFKB1NFKB2RELAPRKCA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3649184-A1 SILICONE COMPOUNDS The Procter and Gamble Company (US) 2020-05-13 EP claimed
EP-3649183-A1 SILICONE COMPOUNDS The Procter and Gamble Company (US) 2020-05-13 EP claimed
WO-2019010263-A1 SILICONE COMPOUNDS THE PROCTER & GAMBLE COMPANY (US) 2019-01-10 WO claimed
US-20190010427-A1 SILICONE COMPOUNDS THE PROCTER & GAMBLE COMPANY 2019-01-10 US claimed
WO-2019010265-A1 SILICONE COMPOUNDS THE PROCTER & GAMBLE COMPANY (US) 2019-01-10 WO claimed
US-20190010293-A1 SILICONE COMPOUNDS THE PROCTER & GAMBLE COMPANY 2019-01-10 US claimed
WO-2018145219-A1 PHARMACEUTICAL COMPOSITION FOR PREVENTING AND TREATING ADDICTIONS BY MEANS OF AVERSIVE COUNTERCONDITIONING SERANI MOSTAZAL JORGE (CL) 2018-08-16 WO claimed
CN-103449995-B Method of removing aldehydes impurities in cyclohexanone-containing technology materials CHINA PETROLEUM & CHEMICAL 2015-07-01 CN claimed
US-5081310-A PROCESS FOR PREPARING OPTICALLY ACTIVE KETONES TAKASAGO INTERNATIONAL CORPORATION (JP) 1992-01-14 US claimed
CN-118103345-A Method for producing compound comprising isomerization step of alpha, beta-unsaturated ketone 花王株式会社 2024-05-28 CN disclosed
CN-110891615-B System and method for selecting and releasing fragrance 阿甘香气及精细化学有限公司 2022-08-05 CN disclosed
EP-3649183-A1 SILICONE COMPOUNDS The Procter and Gamble Company (US) 2020-05-13 EP disclosed
EP-3649184-A1 SILICONE COMPOUNDS The Procter and Gamble Company (US) 2020-05-13 EP disclosed
CN-107338043-B Novel racemic chiral organic boron-nitrogen fluorescent compound and preparation method thereof 湖南大学 2020-04-24 CN disclosed
WO-2004058677-A1 PROCESS FOR REDUCING THE ALDEHYDE CONCENTRATION IN A MIXTURE COMPRISING CYCLOHEXANONE AND ONE OR MORE ALDEHYDES DSM IP ASSETS B.V. (NL) 2004-07-15 WO disclosed
EP-1433774-A1 Process for reducing the aldehyde concentration in a mixture comprising cyclohexanone and one or more aldehydes Koninklijke DSM N.V. (NL) 2004-06-30 EP disclosed
EP-0409530-B1 Catalytic preparation of optically active ketones TAKASAGO PERFUMERY CO LTD (JP) 1993-12-08 EP disclosed
US-5081310-A PROCESS FOR PREPARING OPTICALLY ACTIVE KETONES TAKASAGO INTERNATIONAL CORPORATION (JP) 1992-01-14 US disclosed
EP-0409530-A1 Catalytic preparation of optically active ketones Takasago International Corporation (JP) 1991-01-23 EP disclosed
EP-0084286-B1 PROCESS FOR THE PREPARATION OF EPSILON-CAPROLACTONE ELF ATOCHEM S.A. (FR) 1985-09-18 EP disclosed