SCHEMBL2269129

SCHEMBL2269129

O=C(O)c1ccc(OC(CC2CCCCC2)c2ccc(-c3ccc(C(F)(F)F)cc3)nc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 4/20 0.40
PPARA Q07869 2/20 0.39
GCGR P47871 4/20 0.39
PIK3CA P42336 1/20 0.39
MTOR P42345 1/20 0.39
APP P05067 1/20 0.39
PSEN1 P49768 1/20 0.39
PSEN2 P49810 1/20 0.39
APH1B Q8WW43 1/20 0.39
NCSTN Q92542 1/20 0.39
APH1A Q96BI3 1/20 0.39
PSENEN Q9NZ42 1/20 0.39
DGAT1 O75907 1/20 0.38
TRPM8 Q7Z2W7 1/20 0.38
GIPR P48546 1/20 0.38
PTGER4 P35408 1/20 0.37
MAP4K4 O95819 1/20 0.37
ADRB1 P08588 1/20 0.37
ADRB3 P13945 1/20 0.37
NPC1 O15118 1/20 0.36

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
SCHEMBL2269123 1.00 PPARD (0.40) PPARDPPARAGCGRPIK3CAMTOR
SCHEMBL2270317 0.90 LMNA (0.42) PPARDPPARAGCGRMTORSMN1; SMN2
SCHEMBL2272422 0.90 LMNA (0.42) PPARDPPARAGCGRMTORSMN1; SMN2
SCHEMBL2269807 0.89 ADRB1 (0.43) PPARDGCGRAPPPSEN1PSEN2
SCHEMBL2269811 0.89 ADRB1 (0.43) PPARDGCGRAPPPSEN1PSEN2
SCHEMBL2270701 0.88 GCGR (0.54) GCGRGIPR
SCHEMBL2270697 0.88 GCGR (0.54) GCGRGIPR
SCHEMBL2272009 0.88 GCGR (0.54) GCGRGIPR
SCHEMBL2275079 0.84 GCGR (0.48) PPARDPPARAGCGRPTGER4MAP4K4
SCHEMBL2346540 0.84 GCGR (0.48) PPARDPPARAGCGRPTGER4MAP4K4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1758859-B1 GLUCAGON RECEPTOR ANTAGONISTS, PREPARATION AND THERAPEUTIC USES LILLY CO ELI (US) 2013-07-17 EP disclosed
US-7989457-B2 Used to treat diabetic and other glucagon related metabolic disorders such as obesity, hyperglycemia, atherosclerosis, ischemic heart disease, stroke, neuropathy, and wound healing; (R,S)-Methanesulfonic acid 2-(3-methyl-4'-trifluoromethyl-biphenyl-4-yl)-propyl ester ELI LILLY AND COMPANY (US) 2011-08-02 US disclosed
US-20080125468-A1 Glucagon Receptor Antagonists, Preparation and Therapeutic Uses ELI LILLY AND COMPANY 2008-05-29 US disclosed
EP-1758859-A1 GLUCAGON RECEPTOR ANTAGONISTS, PREPARATION AND THERAPEUTIC USES ELI LILLY AND COMPANY (US) 2007-03-07 EP disclosed
WO-2005118542-A1 GLUCAGON RECEPTOR ANTAGONISTS, PREPARATION AND THERAPEUTIC USES ELI LILLY AND COMPANY (US) 2005-12-15 WO 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-20080125468-A1 Glucagon Receptor Antagonists, Preparation and Therapeutic Uses GLP1R, GCGR, GIPR PPARD 135/4885PPARA 204/4885GCGR 2/4885

“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.