SCHEMBL5873765

SCHEMBL5873765

CCc1ccc(NC(=O)Nc2ccc3nc(N4CC5CCC4CC5)ccc3c2)cn1

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 11/20 0.54
MAPT P10636 4/20 0.36
POLB P06746 3/20 0.36
NPC1 O15118 3/20 0.36
PRMT3 O60678 2/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
TP53 P04637 1/20 0.35
BLM P54132 1/20 0.35
RAB9A P51151 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
CCNE1 P24864 1/20 0.35
CDK2 P24941 1/20 0.35
CDK5 Q00535 1/20 0.35
HRH3 Q9Y5N1 1/20 0.34
KDM4E B2RXH2 1/20 0.34

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
SCHEMBL5873704 0.87 MCHR1 (0.62) MCHR1MAPTNPC1MEN1KMT2A
SCHEMBL5873567 0.83 MCHR1 (0.61) MCHR1MAPTKDM4E
SCHEMBL5873563 0.83 MCHR1 (0.65) MCHR1NPC1MEN1KMT2ARAB9A
SCHEMBL5873663 0.81 MCHR1 (0.63) MCHR1MAPTNPC1MEN1KMT2A
SCHEMBL5873481 0.81 MCHR1 (0.55) MCHR1POLBNPC1MEN1KMT2A
SCHEMBL5873688 0.81 MCHR1 (0.55) MCHR1MAPTPOLBNPC1MEN1
SCHEMBL5873575 0.81 MCHR1 (0.55) MCHR1MAPTPOLBNPC1MEN1
SCHEMBL5873634 0.79 MCHR1 (0.75) MCHR1HRH3
SCHEMBL5873541 0.79 MCHR1 (0.55) MCHR1MAPTPOLBNPC1MEN1
SCHEMBL5873585 0.79 MCHR1 (0.42) MCHR1HRH3

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 4 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
EP-1450801-A2 2-AMINOQUINOLINE COMPOUNDS Merck & Co., Inc. (US) 2004-09-01 EP claimed
WO-2003045313-A2 2-AMINOQUINOLINE COMPOUNDS MERCK & CO. INC. (US) 2003-06-05 WO 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 1/4885MAPT 545/4885POLB 4208/4885

“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.