SCHEMBL2273226

SCHEMBL2273226

OC(CC1CCCCC1)c1ccccc1-c1ccc(C(F)(F)F)cc1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
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
MGLL Q99685 1/20 0.39
IDO1 P14902 3/20 0.39
TDO2 P48775 3/20 0.39
TRPV3 Q8NET8 7/20 0.38
MTTP P55157 1/20 0.38
DPEP1 P16444 1/20 0.38
CHRM3 P20309 2/20 0.37
CHRM1 P11229 1/20 0.37

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
SCHEMBL2269472 0.80 MGLL (0.43) APPPSEN1PSEN2APH1BNCSTN
SCHEMBL2275110 0.80 MGLL (0.43) APPPSEN1PSEN2APH1BNCSTN
SCHEMBL2275107 0.80 MGLL (0.43) APPPSEN1PSEN2APH1BNCSTN
SCHEMBL2652638 0.78 TRPV3 (0.46) MGLLTRPV3MTTPCHRM3
SCHEMBL2269629 0.78 MGLL (0.43) APPPSEN1PSEN2APH1BNCSTN
SCHEMBL2269641 0.77 CNR2 (0.48) IDO1TDO2
SCHEMBL2269646 0.77 CNR2 (0.48) IDO1TDO2
SCHEMBL2269649 0.77 CNR2 (0.48) IDO1TDO2
SCHEMBL2275291 0.76 MGLL (0.51) APPPSEN1PSEN2APH1BNCSTN
SCHEMBL2842733 0.76 PSEN1 (0.42) APPPSEN1PSEN2APH1BNCSTN

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 APP 1016/4885PSEN1 3045/4885PSEN2 3107/4885

“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.