SCHEMBL42929

SCHEMBL42929

CCC(O)(C(C)=O)C(=O)O

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.38
TSHR P16473 2/20 0.38
FFAR3 O14843 2/20 0.33
TDP1 Q9NUW8 1/20 0.33
MEN1 O00255 1/20 0.33
CYP1A2 P05177 1/20 0.33
THRB P10828 1/20 0.33
KMT2A Q03164 1/20 0.33
HMGCR P04035 1/20 0.32
CHRM1 P11229 1/20 0.32
TBXA2R P21731 1/20 0.32
ADRA1A P35348 1/20 0.32
LCK P06239 1/20 0.32
FYN P06241 1/20 0.32
CYP2D6 P10635 1/20 0.31
CYP2C19 P33261 1/20 0.31
HIF1A Q16665 1/20 0.31
TET2 Q6N021 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
SCHEMBL2505815 1.00 ALDH1A1 (0.38) ALDH1A1TSHRFFAR3TDP1MEN1
SCHEMBL938483 1.00 ALDH1A1 (0.38) ALDH1A1TSHRFFAR3TDP1MEN1
SCHEMBL8524045 0.85 ALDH1A1 (0.39) ALDH1A1TSHRFFAR3TDP1HMGCR
SCHEMBL4540907 0.85 ALDH1A1 (0.44) ALDH1A1TSHRFFAR3TDP1MEN1
SCHEMBL29011393 0.81 FDPS (0.37) ALDH1A1TSHRFFAR3TDP1MEN1
SCHEMBL4845519 0.79 TET2 (0.37) ALDH1A1TSHRFFAR3TDP1MEN1
SCHEMBL27686063 0.79 ALDH1A1 (0.35) ALDH1A1TSHRFFAR3TDP1MEN1
SCHEMBL4845531 0.79 TET2 (0.37) ALDH1A1TSHRFFAR3TDP1MEN1
SCHEMBL1045038 0.76 TDP1 (0.38) ALDH1A1FFAR3TDP1
SCHEMBL29390841 0.76 ALDH1A1 (0.36) ALDH1A1TSHRFFAR3TDP1HMGCR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024222943-A1 CONSTRUCTION AND USE OF GENETIC ENGINEERING STRAIN CAPABLE OF REALIZING CO-PRODUCTION OF BRANCHED CHAIN AMINO ACIDS 元素驱动(杭州)生物科技有限公司 2024-10-31 WO claimed
US-11787900-B2 Biodegradable sustainable polyesters MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2023-10-17 US claimed
US-20230151142-A1 BIODEGRADABLE SUSTAINABLE POLYESTERS MASSACHUSETTS INSTITUTE OF TECHNOLOGY 2023-05-18 US claimed
WO-2023081515-A1 BIODEGRADABLE SUSTAINABLE POLYESTERS MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2023-05-11 WO claimed
CN-104254606-B Novel synthesis-regulated sRNA and preparation method thereof 韩国科学技术院 2019-01-18 CN claimed
EP-2834360-B1 AUTO-INDUCIBLE EXPRESSION SYSTEM, AND THE USE THEREOF FOR PRODUCING USEFUL METABOLITES USING A BACTERIUM OF THE FAMILY ENTEROBACTERIACEAE AJINOMOTO KK (JP) 2018-05-23 EP claimed
WO-2018037097-A1 METHOD FOR PREPARING RICH CULTURE MEDIA FOR LABELLING AMINO ACIDS INCORPORATED INTO PROTEINS COMMISSARIAT A L'ENERGIE ATOMIQUE ET AUX ENERGIES ALTERNATIVES (FR) 2018-03-01 WO claimed
US-9574216-B2 Auto-indicible expression system, and the use thereof for producing useful metabolites using a bacterium of the family enterobacteriaceae AJINOMOTO CO., INC. (JP) 2017-02-21 US claimed
US-20160369214-A1 In-Line Detection of Chemical Compounds in Beer UNIVERSITY OF NORTHERN COLORADO 2016-12-22 US claimed
CN-104334729-B Autologous inducible expression, and utilizing enterobacteriaceae lactobacteriaceae to produce the purposes in useful metabolin 味之素株式会社 2016-06-29 CN claimed
WO-2009076480-A2 METHYLBUTANOL AS AN ADVANCED BIOFUEL SYNTHETIC GENOMICS, INC. (US) 2009-06-18 WO claimed
WO-2008078911-A1 METHOD FOR SCREENING ESSENTIAL METABOLITES IN GROWTH OF MICROORGANISMS KOREA ADVANCED INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2008-07-03 WO claimed
US-7166706-B2 Use of ketol-acid reductoisomerase inhibitors to prevent or treat fungal infection of plants BAYER CROPSCIENCE S.A. (FR) 2007-01-23 US claimed
US-20040259848-A1 Use of ketol-acid reductoisomerase inhibitors to prevent or treat fungal infection of plants BAYER S.A.S. (FR) 2004-12-23 US claimed
WO-2004104176-A2 METHOD FOR THE IDENTIFICATION OF INHIBITORS OF ORNITHINE CARBAMOYLTRANSFERASE, KETOL-ACID REDUCTOISOMERASE, AND FUNGAL PATHOGENICITY-CONFERRING GENE AS ANTIBIOTICS PARADIGM GENETICS, INC. (US) 2004-12-02 WO claimed
US-6737255-B2 BY CULTIVATING A BACTERIUM HARBORING A DNA CODING FOR ACTOHYDROXY ACID SYNTHASE ISOZIME III ORIGINATING FROM ESCHERICHIA COLI WHICH IS FREE FROM INHIBITION BY L-VALINE AND HAS SPECIFIED OTHER PROPERTIES; DNA AJINOMOTO CO., INC. (JP) 2004-05-18 US claimed
US-20020037562-A1 Mutant ilvH gene and method for producing L-valine AJINOMOTO CO., INC. (JP) 2002-03-28 US claimed
WO-2001077366-A1 POSITIVE SELECTION METHOD, COMPOUNDS, HOST CELLS AND USES THEREOF CUBIST PHARMACEUTICALS, INC. (US) 2001-10-18 WO claimed
US-5206135-A Pyruvate, alpha-ketobutyrate, alpha-acetolactate and alpha-aceto-alpha-hydroxybutyrate substrates; oxygen-sensitive electrode E. I. DU PONT DE NEMOURS AND COMPANY (US) 1993-04-27 US claimed
US-4329427-A BREVIBACTERIUM CULTURE W. R. GRACE & CO. (US) 1982-05-11 US claimed