SCHEMBL874009

SCHEMBL874009

CCCCC(SC)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.50
MAPK1 P28482 1/20 0.50
HSD17B10 Q99714 1/20 0.45
GPR84 Q9NQS5 3/20 0.43
FFAR1 O14842 1/20 0.43
ALOX5 P09917 5/20 0.43
PPARG P37231 5/20 0.43
PPARA Q07869 4/20 0.43
SLC1A3 P43003 1/20 0.42
SLC1A2 P43004 1/20 0.42
SLC1A1 P43005 1/20 0.42
PTGES O14684 3/20 0.42
MAPT P10636 1/20 0.42
LCK P06239 1/20 0.42
PPARD Q03181 1/20 0.42
ZDHHC20 Q5W0Z9 1/20 0.42
ZDHHC2 Q9UIJ5 1/20 0.42
CHRM1 P11229 1/20 0.41
AKR1A1 P14550 1/20 0.41
CHRM3 P20309 1/20 0.41

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
SCHEMBL18786585 1.00 CA2 (0.50) CA2MAPK1HSD17B10GPR84FFAR1
SCHEMBL873926 0.91 GPR84 (0.55) CA2GPR84FFAR1SLC1A2SLC1A1
SCHEMBL9567321 0.91 GPR84 (0.55) CA2GPR84FFAR1SLC1A2SLC1A1
SCHEMBL11571764 0.90 GPR84 (0.53) CA2GPR84FFAR1SLC1A2SLC1A1
SCHEMBL2554935 0.86
SCHEMBL9068438 0.84 CA2 (0.52) CA2MAPK1HSD17B10GPR84FFAR1
SCHEMBL28712492 0.82 CA2 (0.50) CA2MAPK1HSD17B10GPR84FFAR1
SCHEMBL1478760 0.80 CA2 (0.48) CA2MAPK1HSD17B10GPR84FFAR1
SCHEMBL5321452 0.80 CA2 (0.48) CA2MAPK1HSD17B10GPR84FFAR1
SCHEMBL15750965 0.80 CA2 (0.54) CA2MAPK1HSD17B10GPR84FFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024163921-A2 METHODS AND COMPOSITIONS FOR ALTERING METABOLITES IN HOP PLANTS IMPELLO BIOSCIENCES, INC. (US) 2024-08-08 WO claimed
CN-102970972-B Use of nitrocarboxylic acids for the treatment, diagnosis and prevention of aggressive healing patterns DIETZ ULRICH (DE) 2015-12-16 CN claimed
US-7771769-B2 Flavouring a foodstuff by incorporating an effective amount of at least one compound of the formula R1-S-R2 in which R1 and R2 represent a specific atom or group QUEST INTERNATIONAL B.V. (NL) 2010-08-10 US claimed
US-20100143563-A1 FLAVOURING A FOODSTUFF BY INCORPORATING AN EFFECTIVE AMOUNT OF AT LEAST ONE COMPOUND OF THE FORMULA R1-S-R2 IN WHICH R1 AND R2 REPRESENT A SPECIFIC ATOM OR GROUP QUEST INTERNATIONAL B.V. (NL) 2010-06-10 US claimed
WO-2024163921-A2 METHODS AND COMPOSITIONS FOR ALTERING METABOLITES IN HOP PLANTS IMPELLO BIOSCIENCES, INC. (US) 2024-08-08 WO disclosed
US-20210289794-A1 COMPOSITIONS AND RELATED METHODS FOR AGRICULTURE FLAGSHIP PIONEERING INNOVATIONS V, INC. 2021-09-23 US disclosed
CN-107823720-B Balloon surface coating 德国凯德诺有限责任公司 2021-01-29 CN disclosed
CN-107823721-B Balloon surface coating 德国凯德诺有限责任公司 2021-01-29 CN disclosed
CN-107823719-B Balloon surface coating 德国凯德诺有限责任公司 2021-01-29 CN disclosed
CN-106488970-B Method and use for refining a lipid phase 德雷伊利林PVG有限责任两合公司 2020-12-15 CN disclosed
US-20200171214-A1 BIORESORBABLE SURFACE COATING FOR DELAYING DEGRADATION DREI LILIEN PVG GMBH & CO. KG (DE) 2020-06-04 US disclosed
EP-3648806-A1 BIORESORBABLE SURFACE COATING FOR DELAYING DEGRADATION Drei Lilien PVG GmbH & Co. KG (DE) 2020-05-13 EP disclosed
US-4613510-A Flavoring with Mercapto-C2 -C3 -alkanoic esters INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1986-09-23 US disclosed
US-4600576-A FOODS, PERFUMES INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1986-07-15 US disclosed
US-4594254-A Flavoring with methylthioalkanoic acid esters INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1986-06-10 US disclosed
US-4590082-A FOR FOODS INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1986-05-20 US disclosed
US-4557941-A ORGANOLEPTIC INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1985-12-10 US disclosed
US-4552770-A FOODS, CHEWING GUM INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1985-11-12 US disclosed
US-4521613-A ORGANOLEPTICS INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1985-06-04 US disclosed
US-RE30370-E Flavoring foodstuffs with a thioester INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1980-08-12 US disclosed