SCHEMBL2933175

SCHEMBL2933175

CCCOc1cccc(CO)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.56
TSHR P16473 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
DHFR P00374 1/20 0.50
GGPS1 O95749 2/20 0.48
CYP2D6 P10635 2/20 0.47
ROCK2 O75116 1/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2C9 P11712 1/20 0.47
ROCK1 Q13464 1/20 0.47
GPBAR1 Q8TDU6 1/20 0.47
CYSLTR1 Q9Y271 1/20 0.47
MAPK1 P28482 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
KDM4E B2RXH2 1/20 0.46
ALDH1A1 P00352 1/20 0.46
MEP1B Q16820 1/20 0.46
POLB P06746 1/20 0.46
CA1 P00915 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
SCHEMBL8036345 0.91 GGPS1 (0.54) TSHRSMN1; SMN2DHFRGGPS1CYP2D6
SCHEMBL22307043 0.90 ALDH1A1 (0.49) KMT2ATSHRSMN1; SMN2DHFRGGPS1
SCHEMBL15016836 0.89 GGPS1 (0.59) TSHRDHFRGGPS1CYP2D6
SCHEMBL6272095 0.88 GGPS1 (0.62) TSHRDHFRGGPS1CYP2D6
SCHEMBL10427945 0.88 GGPS1 (0.62) TSHRDHFRGGPS1CYP2D6
SCHEMBL25173132 0.88 GGPS1 (0.62) TSHRDHFRGGPS1CYP2D6
SCHEMBL8956773 0.88 GGPS1 (0.62) TSHRDHFRGGPS1CYP2D6
SCHEMBL6668986 0.88 GGPS1 (0.62) TSHRDHFRGGPS1CYP2D6
SCHEMBL15779393 0.88 GGPS1 (0.62) TSHRDHFRGGPS1CYP2D6
SCHEMBL16902876 0.86 TSHR (0.54) TSHRSMN1; SMN2GGPS1GPBAR1CYSLTR1

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
CN-117304205-A Benzimidazole ternary fused ring compound, pharmaceutically acceptable salt thereof and application thereof 中国科学院广州生物医药与健康研究院 2023-12-29 CN disclosed
CN-107074721-B Method for preparing terephthalic acid diester by refluxing alcohol enrichment 巴斯夫欧洲公司 2021-01-08 CN disclosed
CN-107074720-B Process for the preparation of terephthalic acid diesters with recycling of the reaction mixture 巴斯夫欧洲公司 2021-01-08 CN disclosed
US-10266477-B2 Method for producing diesters of terephthalic acid with enrichment of recirculated alcohol BASF SE (DE) 2019-04-23 US disclosed
US-10239818-B2 Method for producing diesters of terephthalic acid with circulation of the reaction mixture BASF SE (DE) 2019-03-26 US disclosed
US-10207978-B2 Method for producing diesters of terephthalic acid with a dehydration of recirculated alcohol BASF SE (DE) 2019-02-19 US disclosed
EP-3197859-B1 METHOD FOR PRODUCING DIESTERS OF TEREPHTHALIC ACID WITH A DEHYDRATION OF RECIRCULATED ALCOHOL BASF SE (DE) 2019-02-06 EP disclosed
EP-3197858-B1 METHOD FOR PRODUCING DIESTERS OF TEREPHTHALIC ACID WITH CIRCULATION OF THE REACTION MIXTURE BASF SE (DE) 2019-02-06 EP disclosed
EP-3197861-B1 METHOD FOR PRODUCING DIESTERS OF TEREPHTHALIC ACID BASF SE (DE) 2018-08-01 EP disclosed
US-9988338-B2 Method for producing diesters of terephthalic acid BASF SE (DE) 2018-06-05 US disclosed
US-4544652-A α-Hydroxyethylphosphinates, and their use as fungicides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1985-10-01 US disclosed
US-4537720-A N-substituted-2-(R)-(sulfinic acid)-3-(S)-(acylamino)-4-oxo-azetidines and process ELI LILLY AND COMPANY (US) 1985-08-27 US disclosed
US-4477660-A 7-(S)-Acylaminocephalosporin sulfones and process ELI LILLY AND COMPANY (US) 1984-10-16 US disclosed
US-4474879-A Process for 3-hydroxymethyl cephalosporin sulfones ELI LILLY AND COMPANY (US) 1984-10-02 US disclosed
US-4459405-A Desacetylcephalosporin sulfones ELI LILLY AND COMPANY (US) 1984-07-10 US disclosed
EP-0109301-A2 7-(S)-acylaminocephalosporin sulfones and process ELI LILLY AND COMPANY (US) 1984-05-23 EP disclosed
EP-0109300-A2 Desacetylcephalosporin sulfones ELI LILLY AND COMPANY (US) 1984-05-23 EP disclosed
US-4436596-A N-Substituted-2-(R)-(sulfinic acid)-3-(S)-(acylamido)-4-oxo-azetidines and process ELI LILLY AND COMPANY (US) 1984-03-13 US disclosed
US-4436804-A Light-sensitive polymeric diazonium condensates and reproduction compositions and materials therewith AMERICAN HOECHST CORPORATION (US) 1984-03-13 US disclosed
EP-0093010-A2 Alpha-hydroxyethylphosphinates, and their production and use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1983-11-02 EP disclosed