SCHEMBL458613

SCHEMBL458613

CCCCC(CO)C(=O)O

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 7/20 0.71
MAPK1 P28482 1/20 0.71
SLC1A2 P43004 3/20 0.59
SLC1A1 P43005 3/20 0.59
SLC1A3 P43003 2/20 0.59
CHRM1 P11229 1/20 0.54
AKR1A1 P14550 1/20 0.54
CHRM3 P20309 1/20 0.54
HTR2A P28223 1/20 0.54
HTR2C P28335 1/20 0.54
ADRA1A P35348 1/20 0.54
HRH1 P35367 1/20 0.54
DRD3 P35462 1/20 0.54
SLC6A3 Q01959 1/20 0.54
HDAC1 Q13547 1/20 0.54
HDAC2 Q92769 1/20 0.54
TDP1 Q9NUW8 1/20 0.54
GRIK1 P39086 3/20 0.52
GRIK2 Q13002 3/20 0.52
CA1 P00915 4/20 0.50

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
SCHEMBL2563667 1.00 CA2 (0.71) CA2MAPK1SLC1A2SLC1A1SLC1A3
SCHEMBL3185347 1.00 CA2 (0.71) CA2MAPK1SLC1A2SLC1A1SLC1A3
SCHEMBL3865424 0.98 CA2 (0.68) CA2MAPK1SLC1A2SLC1A1SLC1A3
SCHEMBL130285 0.93 CA2 (0.61) CA2MAPK1SLC1A2SLC1A1SLC1A3
SCHEMBL130286 0.93 CA2 (0.61) CA2MAPK1SLC1A2SLC1A1SLC1A3
SCHEMBL1857092 0.91 GRIK1 (0.61) CA2MAPK1SLC1A2SLC1A1SLC1A3
SCHEMBL16970151 0.91 GRIK1 (0.61) CA2MAPK1SLC1A2SLC1A1SLC1A3
SCHEMBL16969979 0.91 GRIK1 (0.61) CA2MAPK1SLC1A2SLC1A1SLC1A3
SCHEMBL16970147 0.91 GRIK1 (0.61) CA2MAPK1SLC1A2SLC1A1SLC1A3
SCHEMBL16970260 0.91 GRIK1 (0.61) CA2MAPK1SLC1A2SLC1A1SLC1A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116547333-A Aromatic polyester polyol compound 亨斯迈国际有限责任公司 2023-08-04 CN claimed
CN-108689903-B Novel preparation method of brivaracetam 北京艾百诺医药股份有限公司 2019-12-24 CN claimed
CN-106046281-A FUNCTIONALIZED KETONE-ALDEHYDE CONDENSATION RESINS 赢创德固赛有限公司 2016-10-26 CN claimed
US-20160289366-A1 FUNCTIONALIZED KETONE-ALDEHYDE CONDENSATION RESINS EVONIK DEGUSSA GMBH (DE) 2016-10-06 US claimed
EP-3075789-A1 FUNCTIONALISED KETONE ALDEHYDE CONDENSATION RESINS Evonik Degussa GmbH (DE) 2016-10-05 EP claimed
EP-1343874-B1 CELLS COMPRISING LACTYL-COA DEHYDRATASE, 3-HYDROXYPROPIONYL-COA DEHYDRATASE OR A MULTIENZYME COMPLEX ISOLATED FROM MEGASPHAERA ELSDENII AND CHLOROFLEXUS AURANTIACUS FOR THE PRODUCTION OF 3-HYDROXYPROPIONIC ACID CARGILL INC (US) 2012-10-03 EP claimed
EP-1706457-B1 PRODUCTION OF 3-HYDROXYPROPIONIC ACID USING BETA-ALANINE/PYRUVATE AMINOTRANSFERASE NOVOZYMES AS (DK) 2012-02-01 EP claimed
EP-1575881-B1 ALANINE 2,3- AMINOMUTASE NOVOZYMES AS (DK) 2009-05-27 EP claimed
US-6879106-B2 Dielectric composition and fabrication method of dielectric layer in plasma display panel LG ELECTRONICS INC. (KR) 2005-04-12 US claimed
US-20030155863-A1 Dielectric composition and fabrication method of dielectric layer in plasma display panel LG ELECTRONICS INC. 2003-08-21 US claimed
US-4448987-A Catalyzed hydrogenation of terephthalic acid to p-hydroxymethylbenzoic acid using a rhenium catalyst STANDARD OIL COMPANY (INDIANA) (US) 1984-05-15 US claimed
CN-116635443-A Polyurethane foam compositions containing aromatic polyester polyol compounds and products made therefrom 亨斯迈国际有限责任公司 2023-08-22 CN disclosed
CN-116547333-A Aromatic polyester polyol compound 亨斯迈国际有限责任公司 2023-08-04 CN disclosed
CN-114539052-A Method for preparing lactate by taking lactic acid fermentation liquor as raw material 安徽丰原发酵技术工程研究有限公司 2022-05-27 CN disclosed
US-11242308-B2 Methods for producing an ester of an alpha, beta-unsaturated carboxylic acid CARGILL, INCORPORATED (US) 2022-02-08 US disclosed
US-4448987-A Catalyzed hydrogenation of terephthalic acid to p-hydroxymethylbenzoic acid using a rhenium catalyst STANDARD OIL COMPANY (INDIANA) (US) 1984-05-15 US disclosed
EP-0016231-B1 METHOD OF MAKING THICK FILM FINE PATTERNS FUJITSU LIMITED (JP) 1983-06-15 EP disclosed
EP-0077036-A1 Binding agent compositions UNION CARBIDE CORPORATION (US) 1983-04-20 EP disclosed
US-4046794-A ANCHORING AGENTS ON GLASS UNION CARBIDE CORPORATION (US) 1977-09-06 US disclosed
US-3993808-A Method for electroless plating gold directly on tungsten or molybdenum HITACHI, LTD. (JA) 1976-11-23 US disclosed