SCHEMBL6494750

SCHEMBL6494750

NCC(C(=O)O)c1ccccc1CN(C(=O)Oc1cccc(OC(F)(F)F)c1)c1ccc(C2CCCCC2)cc1

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
STAT3 P40763 11/20 0.42
GCGR P47871 4/20 0.40
CETP P11597 1/20 0.37
EPHX1 P07099 1/20 0.36
GIPR P48546 1/20 0.35
STAT1 P42224 1/20 0.35
KIF11 P52732 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
Beta-Alanine SCHEMBL6494757 0.81 GCGR (0.51) STAT3GCGRCETPEPHX1
SCHEMBL6494754 0.76 GCGR (0.60) STAT3GCGRGIPR
SCHEMBL2652974 0.73 GCGR (0.71) STAT3GCGRGIPR
SCHEMBL4095401 0.73 GCGR (0.71) STAT3GCGRGIPR
SCHEMBL2653512 0.69 GCGR (0.68) STAT3GCGRGIPR
SCHEMBL2654233 0.66 GCGR (0.58) STAT3GCGRGIPR
SCHEMBL2665560 0.65 GCGR (0.65) STAT3GCGRGIPR
SCHEMBL2665525 0.65 GCGR (0.76) GCGRGIPR
SCHEMBL2655374 0.64 GCGR (0.80) GCGRGIPR
SCHEMBL2652517 0.64 GCGR (0.60) STAT3GCGRGIPR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050203108-A1 Glucagon antagonists/inverse agonists PFIZER INC 2005-09-15 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-20050203108-A1 Glucagon antagonists/inverse agonists GLP1R, GPR119, GCGR STAT3 1079/4885GCGR 3/4885CETP 2095/4885

“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.