SCHEMBL4096742

SCHEMBL4096742

CC(C)(C)C1CCC(C(NC(=O)Nc2cccc(SC(F)(F)F)c2)c2ccc(OCCCC(=O)O)cc2)CC1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
UBE2M P61081 1/20 0.40
DCUN1D1 Q96GG9 1/20 0.40
GAA P10253 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
MAPT P10636 1/20 0.39
PDE2A O00408 6/20 0.38
TRPV1 Q8NER1 3/20 0.38
PPARA Q07869 1/20 0.38
HDAC4 P56524 1/20 0.38
MEF2D Q14814 1/20 0.38
RXFP1 Q9HBX9 3/20 0.37
KDR P35968 1/20 0.35
TEK Q02763 1/20 0.35
NPC1L1 Q9UHC9 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
SCHEMBL4092841 0.85 GCGR (0.46)
SCHEMBL4091912 0.83 GCGR (0.45) PDE2APPARA
SCHEMBL4094171 0.83 PPARA (0.39) GAAMAPTPPARANPC1L1
SCHEMBL4081922 0.82 SLC6A3 (0.47) SMN1; SMN2MAPTHDAC4KDR
SCHEMBL2663019 0.79 GCGR (0.54) NPC1L1
SCHEMBL4094160 0.77 UBE2M (0.43) UBE2MDCUN1D1RXFP1
SCHEMBL4082221 0.76 GCGR (0.47) SMN1; SMN2MAPT
SCHEMBL4081553 0.75 GCGR (0.51) TRPV1
SCHEMBL4092700 0.73 PDE2A (0.39) MAPTPDE2ATRPV1
SCHEMBL6189133 0.72 GCGR (0.54) SMN1; SMN2

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 UBE2M 4466/4885DCUN1D1 1769/4885GAA 484/4885
US-20090143592-A1 Glucagon Antagonists/Inverse Agonists GLP1R, GPR119, GCGR UBE2M 4466/4885DCUN1D1 1769/4885GAA 484/4885
US-20030220350-A1 Glucagon antagonists/inverse agonists GLP1R, GPR119, GCGR UBE2M 4466/4885DCUN1D1 1769/4885GAA 484/4885

“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.