SCHEMBL4925599

SCHEMBL4925599

CCOC(=O)C1CCN(Cc2ccn(-c3ccc(C(F)(F)F)cc3)c2)CC1

nearest known ligand 0.59

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 18/20 0.59
KCNH2 Q12809 13/20 0.59
ALDH1A1 P00352 2/20 0.54
KDM4E B2RXH2 1/20 0.54

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
SCHEMBL5790478 0.86 KDM4E (0.68) KCNH2ALDH1A1KDM4E
SCHEMBL4926337 0.85 MCHR1 (0.59) MCHR1KCNH2ALDH1A1KDM4E
SCHEMBL5316462 0.85 MCHR1 (0.65) MCHR1KCNH2
Hydrochloric Acid SCHEMBL27710070 0.83 MCHR1 (0.63) MCHR1KCNH2
Chlorolithium SCHEMBL4922637 0.82 MCHR1 (0.62) MCHR1KCNH2
SCHEMBL4915594 0.80 MCHR1 (0.59) MCHR1KCNH2
SCHEMBL6028710 0.79 GAA (0.65) ALDH1A1KDM4E
SCHEMBL5316946 0.79 MCHR1 (0.72) MCHR1KCNH2
SCHEMBL2167020 0.79 MAPT (0.64) ALDH1A1KDM4E
SCHEMBL5316616 0.78 MCHR1 (0.59) MCHR1KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080306055-A1 Heterocyclic Mchr1 Antagonists And Their Use In Therapy ASTRAZENECA AB (SE) 2008-12-11 US disclosed
EP-1831194-A1 HETEROCYCLIC MCHr1 ANTAGONISTS AND THEIR USE IN THERAPY AstraZeneca AB (SE) 2007-09-12 EP disclosed
WO-2006068594-A1 HETEROCYCLIC MCHr1 ANTAGONISTS AND THEIR USE IN THERAPY ASTRAZENECA AB (SE) 2006-06-29 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-20080306055-A1 Heterocyclic Mchr1 Antagonists And Their Use In Therapy MCHR1, MCHR2, MC1R MCHR1 1/4885KCNH2 1440/4885ALDH1A1 2408/4885

“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.