SCHEMBL5873663

SCHEMBL5873663

CCc1ccc(NC(=O)Nc2ccc3nc(N4CC5CCC4C5)ccc3c2)cc1

nearest known ligand 0.63

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 11/20 0.63
RAB9A P51151 6/20 0.44
NPC1 O15118 5/20 0.44
MEN1 O00255 2/20 0.38
MAPT P10636 2/20 0.38
KMT2A Q03164 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
EPHX2 P34913 1/20 0.38
OPRM1 P35372 1/20 0.38
OPRD1 P41143 1/20 0.38
HTT P42858 1/20 0.38

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 0.94 MCHR1 (0.62) MCHR1RAB9ANPC1MEN1MAPT
SCHEMBL5873534 0.86 MCHR1 (0.56) MCHR1RAB9ANPC1MEN1MAPT
SCHEMBL5873563 0.86 MCHR1 (0.65) MCHR1RAB9ANPC1MEN1KMT2A
SCHEMBL5873615 0.84 MCHR1 (0.61) MCHR1EPHX2
SCHEMBL5873484 0.83 MCHR1 (0.79) MCHR1
SCHEMBL5873617 0.83 MCHR1 (0.56) MCHR1RAB9ANPC1MAPT
SCHEMBL5873621 0.83 MCHR1 (0.56) MCHR1RAB9ANPC1MAPT
SCHEMBL6560080 0.82 MCHR1 (0.54) MCHR1RAB9ANPC1MEN1MAPT
SCHEMBL5873550 0.82 MCHR1 (0.61) MCHR1
SCHEMBL5873765 0.81 MCHR1 (0.54) MCHR1RAB9ANPC1MEN1MAPT

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 1/4885RAB9A 1226/4885NPC1 1593/4885

“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.