SCHEMBL4087737

SCHEMBL4087737

CCCCC(CC)CC(NC(=O)Nc1cccc(C(F)(F)F)c1)c1ccc(C(=O)NCCC(=O)O)cc1

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HDAC8 Q9BY41 1/20 0.49
EPHX2 P34913 2/20 0.48
GCGR P47871 11/20 0.46
GLP1R P43220 1/20 0.46
GIPR P48546 1/20 0.46
GCG P01275 3/20 0.46
TP53 P04637 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.43
KDM4E B2RXH2 1/20 0.43

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
SCHEMBL2662296 0.91 EPHX2 (0.55) EPHX2GCGRGLP1RGIPRGCG
SCHEMBL6186578 0.83 EPHX1 (0.46) EPHX2GCGRGCGSMN1; SMN2
SCHEMBL4080823 0.83 GCGR (0.45) EPHX2GCGRGCG
SCHEMBL4081999 0.83 GCGR (0.62) EPHX2GCGRGLP1RGIPR
SCHEMBL4092724 0.82 GCGR (0.51) EPHX2GCGR
SCHEMBL4096552 0.81 GCGR (0.53) GCGRGCG
SCHEMBL4087807 0.81 GCGR (0.43) EPHX2GCGRGCG
SCHEMBL4087617 0.80 GCGR (0.47) GCGRGCG
SCHEMBL2663082 0.79 GCGR (0.52) HDAC8EPHX2GCGRGIPRSMN1; SMN2
SCHEMBL4085143 0.74 EPHX2 (0.55) EPHX2GCGRGLP1RGIPRGCG

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
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

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 HDAC8 2820/4885EPHX2 3463/4885GCGR 3/4885
US-20090143592-A1 Glucagon Antagonists/Inverse Agonists GLP1R, GPR119, GCGR HDAC8 2820/4885EPHX2 3463/4885GCGR 3/4885
US-20030220350-A1 Glucagon antagonists/inverse agonists GLP1R, GPR119, GCGR HDAC8 2820/4885EPHX2 3463/4885GCGR 3/4885

“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.