SCHEMBL4671674

SCHEMBL4671674

CC(C)CCN(CCC(C)C)C(=O)c1ccc2nc(-c3ccc(C#N)cc3)c(CCCO)n2c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 1/20 0.41
ALB P02768 2/20 0.36
OPRK1 P41145 2/20 0.36
KCNH2 Q12809 2/20 0.36
TSPO P30536 2/20 0.36
NR1I2 O75469 1/20 0.36
ABCB11 O95342 1/20 0.36
ADORA3 P0DMS8 1/20 0.36
ADORA1 P30542 1/20 0.36
OPRM1 P35372 1/20 0.36
DRD3 P35462 1/20 0.36
PDE4D Q08499 1/20 0.36
MC4R P32245 1/20 0.36
PRNP P04156 1/20 0.36
GABRA1 P14867 2/20 0.35
GABRB2 P47870 2/20 0.35
KDM4E B2RXH2 1/20 0.35
LMNA P02545 1/20 0.35
CYP3A4 P08684 1/20 0.35
CHRM1 P11229 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
SCHEMBL11934195 0.95 SLC2A1 (0.42) SLC2A1ALBOPRK1KCNH2TSPO
SCHEMBL4671342 0.90 SLC2A1 (0.41) SLC2A1ALBOPRK1KCNH2TSPO
SCHEMBL4669868 0.88 MC4R (0.45) SLC2A1MC4R
SCHEMBL14046548 0.88 SLC2A1 (0.42) SLC2A1ALBOPRK1KCNH2TSPO
SCHEMBL11929562 0.88 SLC2A1 (0.37) SLC2A1ALBOPRK1KCNH2TSPO
SCHEMBL11929568 0.87 SLC2A1 (0.41) SLC2A1ALBOPRK1KCNH2TSPO
SCHEMBL11929569 0.86 SLC2A1 (0.43) SLC2A1ALBOPRK1KCNH2TSPO
SCHEMBL4669651 0.86 SLC2A1 (0.40) SLC2A1ALBOPRK1KCNH2TSPO
SCHEMBL11929615 0.83 MC4R (0.41) SLC2A1MC4R
SCHEMBL11929567 0.83 SLC2A1 (0.44) SLC2A1ALBOPRK1KCNH2TSPO

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-8236818-B2 Substituted imidazopyridine derivatives as melanocortin-4 receptor antagonists SANTHERA PHARMACEUTICALS (SCHWEIZ) AG (CH) 2012-08-07 US disclosed
US-8236818-B2 Substituted imidazopyridine derivatives as melanocortin-4 receptor antagonists SANTHERA PHARMACEUTICALS (SCHWEIZ) AG (CH) 2012-08-07 US disclosed
US-20100093697-A1 Substituted Imidazopyridine Derivatives As Melanocortin-4 Receptor Antagonists SANTHERA PHARMACEUTICALS (SCHWEIZ) AG (CH) 2010-04-15 US disclosed
US-20100093697-A1 Substituted Imidazopyridine Derivatives As Melanocortin-4 Receptor Antagonists SANTHERA PHARMACEUTICALS (SCHWEIZ) AG (CH) 2010-04-15 US disclosed
EP-1974729-A1 Substituted imidazopyridine derivates as melanocortin- 4 receptor antagonists Santhera Pharmaceuticals (Schweiz) AG (CH) 2008-10-01 EP disclosed
EP-1974729-A1 Substituted imidazopyridine derivates as melanocortin- 4 receptor antagonists Santhera Pharmaceuticals (Schweiz) AG (CH) 2008-10-01 EP 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 (1 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-20100093697-A1 Substituted Imidazopyridine Derivatives As Melanocortin-4 Receptor Antagonists MC4R, MC3R, MC5R SLC2A1 3850/4885ALB 884/4885OPRK1 47/4885

“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.