SCHEMBL5873503

SCHEMBL5873503

CC(C)(C)OC(=O)NC1CCN(c2ccc3cc(NC(=O)C=Cc4ccc(Cl)cc4)ccc3n2)C1

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 13/20 0.52
KCNH2 Q12809 2/20 0.51
PDE10A Q9Y233 1/20 0.48
MAPT P10636 3/20 0.45
MAP4K4 O95819 2/20 0.45
SUV39H2 Q9H5I1 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
SCHEMBL5873497 1.00 MCHR1 (0.52) MCHR1KCNH2PDE10AMAPTMAP4K4
SCHEMBL5873725 0.82 MCHR1 (0.55) MCHR1KCNH2MAPT
SCHEMBL5873730 0.82 MCHR1 (0.55) MCHR1KCNH2MAPT
SCHEMBL6557630 0.81 MCHR1 (0.53) MCHR1KCNH2MAPT
SCHEMBL5873574 0.78 MAP4K4 (0.61) MCHR1PDE10AMAP4K4SUV39H2
Hydrochloric Acid SCHEMBL5873477 0.77 MAPT (0.62) MCHR1MAPT
SCHEMBL22499904 0.77 PDE10A (0.58) MCHR1PDE10AMAP4K4SUV39H2
SCHEMBL29689781 0.77 PDE10A (0.58) MCHR1PDE10AMAP4K4SUV39H2
Hydrochloric Acid SCHEMBL5873480 0.77 MAPT (0.62) MCHR1MAPT
SCHEMBL24166014 0.77 MAP4K4 (0.59) PDE10AMAP4K4SUV39H2

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-7084156-B2 2-Aminoquinoline compounds MERCK & CO., INC. (US) 2006-08-01 US claimed
US-20050026915-A1 2-Aminoquinoline compounds MERCK SHARP & DOHME CORP. 2005-02-03 US claimed

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-20050026915-A1 2-Aminoquinoline compounds MCHR1, MCHR2, MC5R MCHR1 1/4885KCNH2 3741/4885PDE10A 1245/4885

“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.