SCHEMBL3813636

SCHEMBL3813636

O=C(O)CCc1cc(F)ccc1OC1CCCC1

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PTGDR Q13258 4/20 0.57
THRA P10827 2/20 0.47
THRB P10828 2/20 0.47
PTGDR2 Q9Y5Y4 2/20 0.46
RBP4 P02753 1/20 0.45
PDE4A P27815 6/20 0.44
PDE4B Q07343 4/20 0.44
PDE4C Q08493 4/20 0.44
PDE4D Q08499 4/20 0.44
FFAR4 Q5NUL3 4/20 0.44
FFAR1 O14842 3/20 0.44

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
Hydrochloric Acid SCHEMBL2777981 0.87 PTGDR (0.53) PTGDRRBP4FFAR4FFAR1
SCHEMBL3405256 0.83 THRA (0.56) PTGDRTHRATHRBFFAR4
SCHEMBL27724079 0.81 PTGDR (0.48) PTGDRPDE4APDE4BPDE4CPDE4D
SCHEMBL24180131 0.80 PDE4A (0.44) PDE4APDE4BPDE4CPDE4D
SCHEMBL3812430 0.79 THRA (0.53) PTGDRTHRATHRBPTGDR2RBP4
SCHEMBL32689796 0.78 PTGDR (0.59) PTGDRPTGDR2RBP4FFAR4FFAR1
SCHEMBL20472386 0.77 CSNK2A1 (0.51) PDE4A
SCHEMBL29786553 0.77 CSNK2A1 (0.51) PDE4A
SCHEMBL13679006 0.75 PTGDR (0.46) PTGDRPDE4APDE4BPDE4CPDE4D
SCHEMBL6063960 0.75 THRA (0.50) THRATHRBPTGDR2FFAR4FFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1881958-B1 DIACYLGLYCEROL ACYLTRANSFERASE INHIBITORS VIA PHARMACEUTICALS INC (US) 2009-09-09 EP disclosed
US-7485752-B2 Diacylglycerol acyltransferase inhibitors HOFFMAN-LA ROCHE INC. (US) 2009-02-03 US disclosed
CN-101171231-A Diacylglycerol acyltransferase inhibitors HOFFMANN LA ROCHE (CH) 2008-04-30 CN disclosed
US-20060258740-A1 Diacylglycerol acyltransferase inhibitors VIA PHARMACEUTICALS, INC. 2006-11-16 US 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 (1 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-20060258740-A1 Diacylglycerol acyltransferase inhibitors DGAT2, DGAT1, LCAT PTGDR 635/4885THRA 2002/4885THRB 1382/4885

“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.