SCHEMBL871565

SCHEMBL871565

CC(C)(C)OC(=O)N1CCN(c2ccc(-n3ccc(OCc4ccc(Cl)cn4)cc3=O)cn2)CC1

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 11/20 0.48
GPR119 Q8TDV5 3/20 0.47
RET P07949 3/20 0.43
ADK P55263 1/20 0.43
DDB1 Q16531 1/20 0.42
CRBN Q96SW2 1/20 0.42
PGK1 P00558 1/20 0.42

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
SCHEMBL770021 0.89 RET (0.44) MCHR1RET
SCHEMBL770418 0.86 MCHR1 (0.44) MCHR1GPR119
SCHEMBL871433 0.85 DRD4 (0.48) MCHR1RET
SCHEMBL871431 0.85 MCHR1 (0.44) MCHR1
SCHEMBL870726 0.85 MCHR1 (0.56) MCHR1
SCHEMBL1779926 0.84 MCHR1 (0.48) MCHR1
SCHEMBL871566 0.83 MCHR1 (0.42) MCHR1GPR119
SCHEMBL870156 0.82 MCHR1 (0.53) MCHR1
SCHEMBL867665 0.82 MCHR1 (0.47) MCHR1
SCHEMBL870323 0.82 MCHR1 (0.59) MCHR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120077794-A1 BIS-PYRIDYLPYRIDONES AS MELANIN-CONCENTRATING HORMONE RECEPTOR 1 ANTAGONISTS GLAXSMITHKLINE LLC (US) 2012-03-29 US disclosed
WO-2010141538-A1 BIS-PYRIDYLPYRIDONES AS MELANIN-CONCENTRATING HORMONE RECEPTOR 1 ANTAGONISTS GLAXOSMITHKLINE LLC (US) 2010-12-09 WO 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-20120077794-A1 BIS-PYRIDYLPYRIDONES AS MELANIN-CONCENTRATING HORMONE RECEPTOR 1 ANTAGONISTS MCHR1, MCHR2, MC1R MCHR1 1/4885GPR119 12/4885RET 187/4885

“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.