SCHEMBL4095325

SCHEMBL4095325

COc1ccc2nc(NC(=O)NC(c3ccc(C(=O)Nc4nn[nH]n4)cc3)c3ccc(C4CCCCC4)cc3)sc2c1

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.51
RAB9A P51151 3/20 0.51
MAPT P10636 2/20 0.51
SCD O00767 13/20 0.49
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
ITK Q08881 2/20 0.47
LMNA P02545 1/20 0.44
LRRK2 Q5S007 1/20 0.44

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
SCHEMBL4097373 0.91 GCGR (0.51) NPC1RAB9AMAPT
SCHEMBL4091745 0.88 CLK1 (0.49) NPC1RAB9AMAPTMEN1KMT2A
SCHEMBL4081318 0.87 NPC1 (0.46) NPC1RAB9AMAPTSCDMEN1
SCHEMBL2663124 0.82 GCGR (0.53) NPC1RAB9AMAPTSCDMEN1
SCHEMBL4081398 0.79 GCGR (0.49) NPC1RAB9ASCDMEN1KMT2A
SCHEMBL4091748 0.79 GCGR (0.47)
SCHEMBL4086925 0.79 GCGR (0.41) LMNA
SCHEMBL4082061 0.78 GCGR (0.61)
SCHEMBL4086665 0.78 GCGR (0.44) ITKLMNA
SCHEMBL4091972 0.77 GCGR (0.56)

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 2980/4885MAPT 4379/4885
US-20090143592-A1 Glucagon Antagonists/Inverse Agonists GLP1R, GPR119, GCGR NPC1 1959/4885RAB9A 2980/4885MAPT 4379/4885
US-20030220350-A1 Glucagon antagonists/inverse agonists GLP1R, GPR119, GCGR NPC1 1959/4885RAB9A 2980/4885MAPT 4379/4885

“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.