SCHEMBL2650299

SCHEMBL2650299

CS(=O)(=O)c1ccc(NC(=O)NC(c2ccc(C(=O)NCCC(=O)O)cc2)c2ccc(C3CCCCC3)cc2)s1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GCGR P47871 4/20 0.40
CYP2D6 P10635 1/20 0.40
EPHX2 P34913 3/20 0.39
OPRM1 P35372 1/20 0.38
OPRK1 P41145 1/20 0.38
PPARD Q03181 1/20 0.38
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
ADRB3 P13945 1/20 0.36
DGAT1 O75907 3/20 0.35
GCG P01275 3/20 0.35
HDAC3 O15379 1/20 0.35
HDAC11 Q96DB2 1/20 0.35
HDAC8 Q9BY41 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35
DEGS1 O15121 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
SCHEMBL2665113 0.85 GCGR (0.49) GCGRCYP2D6OPRM1OPRK1PPARD
SCHEMBL2652544 0.83 GCG (0.40) GCGREPHX2CA1CA2ADRB3
SCHEMBL4087821 0.82 GCGR (0.48) GCGRCYP2D6EPHX2OPRM1OPRK1
SCHEMBL6751922 0.81 EPHX2 (0.42) GCGRCYP2D6EPHX2OPRM1OPRK1
SCHEMBL2650298 0.81 GCGR (0.61) GCGROPRM1OPRK1
SCHEMBL2651093 0.80 GCGR (0.41) GCGRCYP2D6EPHX2OPRM1OPRK1
SCHEMBL4081733 0.80 EPHX2 (0.45) GCGRCYP2D6EPHX2PPARDGCG
SCHEMBL4087388 0.80 GCGR (0.43) GCGRDGAT1HDAC3HDAC11HDAC8
SCHEMBL2650119 0.80 GCGR (0.41) GCGRCYP2D6EPHX2OPRM1OPRK1
SCHEMBL4096042 0.78 GCGR (0.49) GCGRCYP2D6EPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040127560-A1 Glucagon antagonists/inverse agonists MADSEN PETER (DK) 2004-07-01 US claimed
US-6706744-B2 HYPOGLYCEMIC AGENTS; ANTIDIABETIC AGENTS NOVO NORDISK A/S (DK) 2004-03-16 US claimed
US-20030065031-A1 Glucagon antagonists/inverse agonists PFIZER INC 2003-04-03 US claimed
WO-2002040444-A1 GLUCAGON ANTAGONISTS/INVERSE AGONISTS NOVO NORDISK A/S (DK) 2002-05-23 WO claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 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-20040127560-A1 Glucagon antagonists/inverse agonists GLP1R, GPR119, GCGR GCGR 3/4885CYP2D6 3508/4885EPHX2 2973/4885
US-20030065031-A1 Glucagon antagonists/inverse agonists GLP1R, GPR119, GCGR GCGR 3/4885CYP2D6 3508/4885EPHX2 2973/4885

“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.