SCHEMBL4087091

SCHEMBL4087091

O=C(O)CCNC(=O)c1ccc(C(NC(=O)Nc2ccc(SC(F)(F)F)cc2)c2ccc(C3CCCCC3)cc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GCGR P47871 6/20 0.52
GIPR P48546 2/20 0.52
EPHX2 P34913 3/20 0.46
GCG P01275 4/20 0.41
HDAC3 O15379 1/20 0.41
HDAC11 Q96DB2 1/20 0.41
HDAC8 Q9BY41 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
DEGS1 O15121 1/20 0.41
CHRM4 P08173 1/20 0.40
CYP2D6 P10635 1/20 0.40
NAMPT P43490 1/20 0.40
GLP1R P43220 1/20 0.40
PPARD Q03181 1/20 0.39
MITF O75030 1/20 0.39
KLF5 Q13887 1/20 0.39

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
SCHEMBL4095200 0.90 GCGR (0.48) GCGRGIPREPHX2GCGCYP2D6
SCHEMBL2654362 0.88 GCGR (0.68) GCGRGIPREPHX2HDAC3HDAC11
SCHEMBL2654361 0.88 GCGR (0.68) GCGRGIPREPHX2HDAC3HDAC11
SCHEMBL2647912 0.87 GCGR (0.49) GCGRGIPREPHX2HDAC3HDAC11
SCHEMBL4095266 0.87 GCGR (0.66) GCGRGIPREPHX2GLP1R
SCHEMBL2647136 0.85 GCGR (0.58) GCGRGIPREPHX2HDAC3HDAC11
SCHEMBL2647133 0.85 GCGR (0.58) GCGRGIPREPHX2HDAC3HDAC11
SCHEMBL2651688 0.84 GCGR (0.42) GCGRGIPRGCGCYP2D6PPARD
SCHEMBL2651889 0.84 GCGR (0.42) GCGRGIPRGCGPPARD
SCHEMBL2653167 0.84 GCGR (0.46) GCGRGIPREPHX2GCGHDAC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090143592-A1 Glucagon Antagonists/Inverse Agonists NOVO NORDISK A/S (DK) 2009-06-04 US disclosed
EP-1183229-B1 GLUCAGON ANTAGONISTS/INVERSE AGONISTS NOVO NORDISK AS (DK) 2005-10-26 EP disclosed
US-20050203108-A1 Glucagon antagonists/inverse agonists PFIZER INC 2005-09-15 US disclosed
US-6875760-B2 Glucagon antagonists/inverse agonists NOVO NORDISK A/S (DK) 2005-04-05 US disclosed
US-20030220350-A1 Glucagon antagonists/inverse agonists PFIZER INC 2003-11-27 US disclosed
US-6503949-B1 Treating Type 2 diabetes, hyperglycemia, impaired glucose tolerance or obesity NORO NORDISK A/S (DK) 2003-01-07 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 (3 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 GCGR 3/4885GIPR 4/4885EPHX2 3463/4885
US-20090143592-A1 Glucagon Antagonists/Inverse Agonists GLP1R, GPR119, GCGR GCGR 3/4885GIPR 4/4885EPHX2 3463/4885
US-20030220350-A1 Glucagon antagonists/inverse agonists GLP1R, GPR119, GCGR GCGR 3/4885GIPR 4/4885EPHX2 3463/4885

“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.