SCHEMBL5609564

SCHEMBL5609564

FC(F)(F)C(CCCS)c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 6/20 0.40
HTR2A P28223 6/20 0.40
FOLH1 Q04609 1/20 0.39
PREP P48147 1/20 0.36
TAAR1 Q96RJ0 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
SLC7A5 Q01650 5/20 0.35
SLC6A4 P31645 1/20 0.35
HRH3 Q9Y5N1 1/20 0.35
PARP1 P09874 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
SCHEMBL28088631 0.81 PREP (0.39) HRH1HTR2APREPSLC7A5SLC6A4
SCHEMBL8792907 0.81 PREP (0.39) HRH1HTR2APREPSLC7A5SLC6A4
SCHEMBL22012999 0.79 ESR1 (0.38) HRH1HTR2ATAAR1SLC6A4PARP1
SCHEMBL27260853 0.79 SIGMAR1 (0.41) HRH1HTR2ASLC7A5
SCHEMBL11133727 0.79 SLC7A5 (0.54) HRH1HTR2ATAAR1SLC7A5SLC6A4
SCHEMBL9120332 0.77 HRH1 (0.62) HRH1HTR2AFOLH1TAAR1TDP1
SCHEMBL9181327 0.77 PREP (0.46) PREP
SCHEMBL9335516 0.77 TAAR1 (0.37) HRH1HTR2ATAAR1SLC7A5SLC6A4
SCHEMBL1834199 0.76 PARP1 (0.36) HRH1HTR2APREPSLC7A5SLC6A4
SCHEMBL5610559 0.76 PARP1 (0.36) HRH1HTR2APREPTAAR1SLC7A5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7199139-B2 Medicinal compositions containing diuretic and insulin resistance-improving agent SANKYO COMPANY, LIMITED (JP) 2007-04-03 US disclosed
EP-1354602-B1 MEDICINAL COMPOSITIONS CONTAINING DIURETIC AND INSULIN RESISTANCE-IMPROVING AGENT SANKYO CO (JP) 2006-10-04 EP disclosed
EP-1695716-A2 Medicinal compositions containing diuretics and insulin sensitizers Sankyo Company, Limited (JP) 2006-08-30 EP disclosed
US-20050288339-A1 Medicinal compositions containing diuretic and insulin resistance-improving agent SANKYO COMPANY, LIMITED (JP) 2005-12-29 US disclosed
US-20040053974-A1 Medicinal compositions containing diuretic and insulin resistance-improving agent SANKYO COMPANY, LIMITED (JP) 2004-03-18 US disclosed
US-20040002512-A1 Alpha-substituted carboxylic acid derivatives SANKYO COMPANY, LIMITED (JP) 2004-01-01 US disclosed
EP-1354602-A1 MEDICINAL COMPOSITIONS CONTAINING DIURETIC AND INSULIN RESISTANCE-IMPROVING AGENT Sankyo Company, Limited (JP) 2003-10-22 EP disclosed
US-6596751-B2 An insulin resistance improving agent, hypoglycemic agent, immunoregulatory agent, aldose reductase inhibitor, 5-lipoxygenase inhibitor, peroxidized lipid production suppressor, PPAR. activator, leukotriene antagonist, adipose SANKYO COMPANY LIMITED (JP) 2003-07-22 US disclosed
US-20030069294-A1 Alpha-substituted carboxylic acid derivatives SANKYO COMPANY, LIMITED (JP) 2003-04-10 US disclosed
EP-1167357-A1 ALPHA-SUBSTITUTED CARBOXYLIC ACID DERIVATIVES Sankyo Company, Limited (JP) 2002-01-02 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 (4 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-20040002512-A1 Alpha-substituted carboxylic acid derivatives SLC5A1, SLC2A1, GPR119 HRH1 1043/4885HTR2A 3197/4885FOLH1 3055/4885
US-20030069294-A1 Alpha-substituted carboxylic acid derivatives SLC5A1, SLC2A1, GPR119 HRH1 1043/4885HTR2A 3197/4885FOLH1 3055/4885
US-20040053974-A1 Medicinal compositions containing diuretic and insulin resistance-improving agent GPR119, INSR, IRS1 HRH1 2483/4885HTR2A 4296/4885FOLH1 1599/4885
US-20050288339-A1 Medicinal compositions containing diuretic and insulin resistance-improving agent GPR119, INSR, IRS1 HRH1 2483/4885HTR2A 4296/4885FOLH1 1599/4885

“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.