SCHEMBL4457225

SCHEMBL4457225

Oc1ccc(SC(F)(F)F)cc1Cl

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.45
HSD17B10 Q99714 2/20 0.45
CA2 P00918 2/20 0.42
KDM4E B2RXH2 1/20 0.42
ALDH1A1 P00352 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
CA1 P00915 1/20 0.42
ESR2 Q92731 2/20 0.38
MAPK1 P28482 2/20 0.38
LMNA P02545 2/20 0.38
HTT P42858 2/20 0.38
MAPT P10636 1/20 0.38
PTPRZ1 P23471 2/20 0.37
PTPN1 P18031 1/20 0.37
CYP3A4 P08684 1/20 0.37
KCNH2 Q12809 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
KCNK2 O95069 2/20 0.36
KCNK10 P57789 2/20 0.36
ESR1 P03372 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
SCHEMBL27876484 0.84 ALDH1A1 (0.45) TSHRHSD17B10KDM4EALDH1A1TDP1
SCHEMBL11062721 0.80 HSD17B10 (0.45) TSHRHSD17B10CA2KDM4EALDH1A1
SCHEMBL1022506 0.78 ALDH1A1 (0.54) TSHRHSD17B10CA2KDM4EALDH1A1
SCHEMBL16555940 0.78 ALDH1A1 (0.43) TSHRKDM4EALDH1A1TDP1MAPK1
SCHEMBL10804924 0.77 HSD17B10 (0.44) TSHRHSD17B10KDM4EALDH1A1TDP1
SCHEMBL536362 0.76 HSD17B10 (0.54) TSHRHSD17B10CA2ALDH1A1TDP1
SCHEMBL3628365 0.76 ALDH1A1 (0.52) TSHRHSD17B10CA2KDM4EALDH1A1
SCHEMBL10941731 0.76 ALDH1A1 (0.42) TSHRKDM4EALDH1A1TDP1MAPK1
SCHEMBL30599573 0.76 ALDH1A1 (0.52) TSHRHSD17B10CA2KDM4EALDH1A1
SCHEMBL9798590 0.76 SMN1; SMN2 (0.47) TSHRKDM4EALDH1A1TDP1MAPK1

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 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230017045-A1 PYRIDINE AND PYRIMIDINE CARBOXYLATE HERBICIDES AND METHODS OF USE THEREOF DOW AGROSCIENCES LLC (US) 2023-01-19 US disclosed
EP-3700340-A1 PYRIDINE AND PYRIMIDINE CARBOXYLATE HERBICIDES AND METHODS OF USE THEREOF Dow Agrosciences LLC (US) 2020-09-02 EP disclosed
CN-111278283-A Pyridine and pyrimidine formate herbicides and methods of use thereof 美国陶氏益农公司 2020-06-12 CN disclosed
EP-2955178-A1 CONDENSED HETEROCYCLIC COMPOUND Sumitomo Chemical Company Limited (JP) 2015-12-16 EP disclosed
US-7524882-B2 PPAR alpha selective compounds for the treatment of dyslipidemia and other lipid disorders MERCK & CO., INC. (US) 2009-04-28 US disclosed
EP-1539136-B1 PPAR ALPHA SELECTIVE COMPOUNDS FOR THE TREATMENT OF DYSLIPIDEMIA AND OTHER LIPID DISORDERS MERCK & CO INC (US) 2008-07-09 EP disclosed
EP-1539136-A4 PPAR ALPHA SELECTIVE COMPOUNDS FOR THE TREATMENT OF DYSLIPIDEMIA AND OTHER LIPID DISORDERS MERCK & CO INC (US) 2006-10-18 EP disclosed
US-20050228044-A1 Ppar alpha selective compounds for the treatment of dyslipidemia and other lipid disorders MERCK SHARP & DOHME CORP. 2005-10-13 US disclosed
EP-1539136-A2 PPAR ALPHA SELECTIVE COMPOUNDS FOR THE TREATMENT OF DYSLIPIDEMIA AND OTHER LIPID DISORDERS Merck & Co., Inc. (US) 2005-06-15 EP disclosed
WO-2004010936-A2 PPAR ALPHA SELECTIVE COMPOUNDS FOR THE TREATMENT OF DYSLIPIDEMIA AND OTHER LIPID DISORDERS MERCK & CO., INC. (US) 2004-02-05 WO disclosed
US-4700006-A FUNGICIDES NIHON TOKUSHU NOYAKU SEIZO K.K. (JP) 1987-10-13 US disclosed
US-4609669-A AGRICULTURE, HORTICULTURE NIHON TOKUSHU NOYAKU SEIZO K.K. (JP) 1986-09-02 US disclosed
EP-0104473-B1 PHENOXYALKANOIC-ACID COMPOUNDS FOR REGULATING PLANT GROWTH BASF Aktiengesellschaft (DE) 1986-01-22 EP disclosed
US-4523034-A Herbicidal diphenyl ethers, their preparation and their use as herbicides BASF AKTIENGESELLSCHAFT (DE) 1985-06-11 US disclosed
EP-0104473-A1 Phenoxyalkanoic-acid compounds for regulating plant growth BASF Aktiengesellschaft (DE) 1984-04-04 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20230017045-A1 PYRIDINE AND PYRIMIDINE CARBOXYLATE HERBICIDES AND METHODS OF USE THEREOF PDXK, DPYD, DDT TSHR 1867/4885HSD17B10 1881/4885CA2 1070/4885
US-20050228044-A1 Ppar alpha selective compounds for the treatment of dyslipidemia and other lipid disorders PPARD, PPARA, PPARG TSHR 1138/4885HSD17B10 72/4885CA2 4816/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.