SCHEMBL4085103

SCHEMBL4085103

CCOC(=O)c1ccc2nc(NC(=O)N(Cc3ccc(C(=O)NCCC(=O)O)cc3)C3(C(C)(C)C)CCCCC3)sc2c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 10/20 0.47
RAB9A P51151 9/20 0.47
SMN1; SMN2 Q16637 8/20 0.47
KDM4E B2RXH2 3/20 0.47
STAT1 P42224 1/20 0.47
ALDH1A1 P00352 4/20 0.46
TP53 P04637 2/20 0.46
HSD17B10 Q99714 2/20 0.46
MAPT P10636 2/20 0.46
USP2 O75604 1/20 0.46
HPGD P15428 2/20 0.45
NFKB1 P19838 1/20 0.45
NFKB2 Q00653 1/20 0.45
RELA Q04206 1/20 0.45
ACP1 P24666 1/20 0.42
ALPL P05186 1/20 0.42
GAA P10253 1/20 0.42
PKM P14618 1/20 0.42
CASR P41180 1/20 0.41
PCSK9 Q8NBP7 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
SCHEMBL4085101 0.81 GCGR (0.60) GCGR
SCHEMBL2663046 0.81 GCGR (0.60) GCGR
SCHEMBL4085229 0.75 GCGR (0.64) GCGR
SCHEMBL4087162 0.73 GCGR (0.48) GCGR
SCHEMBL4096544 0.72 GCGR (0.43) TP53MAPTGCGR
SCHEMBL4092650 0.69 GCGR (0.55) GCGR
SCHEMBL4088222 0.69 GCGR (0.43) RAB9AHTTGCGR
SCHEMBL14808429 0.68 SMN1; SMN2 (0.77) NPC1RAB9ASMN1; SMN2KDM4ESTAT1
SCHEMBL5348071 0.68 NPC1 (0.78) NPC1RAB9ASMN1; SMN2KDM4ESTAT1
SCHEMBL2653696 0.68 GCGR (0.75) GCGR

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 NPC1 1959/4885RAB9A 2980/4885SMN1; SMN2 3528/4885
US-20090143592-A1 Glucagon Antagonists/Inverse Agonists GLP1R, GPR119, GCGR NPC1 1959/4885RAB9A 2980/4885SMN1; SMN2 3528/4885
US-20030220350-A1 Glucagon antagonists/inverse agonists GLP1R, GPR119, GCGR NPC1 1959/4885RAB9A 2980/4885SMN1; SMN2 3528/4885

“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.