SCHEMBL6199646

SCHEMBL6199646

Nc1c2c(nc3ccc(NC(=O)C=Cc4ccc(Cl)cc4)cc13)CCCC2

nearest known ligand 0.59

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 7/20 0.59
TP53 P04637 4/20 0.56
MAPT P10636 4/20 0.56
SMN1; SMN2 Q16637 4/20 0.56
ACHE P22303 8/20 0.56
BCHE P06276 7/20 0.55
GRIN1 Q05586 4/20 0.55
GRIN2A Q12879 4/20 0.55
SLC2A1 P11166 1/20 0.52
BLM P54132 1/20 0.51
APP P05067 1/20 0.50

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
SCHEMBL6199638 1.00 MCHR1 (0.59) MCHR1TP53MAPTSMN1; SMN2ACHE
SCHEMBL6198941 0.89 MCHR1 (0.65) MCHR1TP53MAPTSMN1; SMN2
SCHEMBL6198936 0.89 MCHR1 (0.65) MCHR1TP53MAPTSMN1; SMN2
SCHEMBL6203830 0.87 MCHR1 (0.55) MCHR1TP53MAPTSMN1; SMN2
SCHEMBL6203837 0.87 MCHR1 (0.55) MCHR1TP53MAPTSMN1; SMN2
SCHEMBL6203005 0.86 MCHR1 (0.55) MCHR1ACHE
SCHEMBL6203011 0.86 MCHR1 (0.55) MCHR1ACHE
SCHEMBL23758881 0.78 MCHR1 (0.76) MCHR1MAPTBLM
SCHEMBL6203293 0.77 MCHR1 (0.78) MCHR1
SCHEMBL6204610 0.77 MCHR1 (0.78) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1451156-A4 4-AMINOQUINOLINE COMPOUNDS MERCK & CO INC (US) 2005-05-25 EP claimed
US-20050009815-A1 4-Aminoquinoline compounds DEVITA ROBERT J (US) 2005-01-13 US claimed
EP-1451156-A1 4-AMINOQUINOLINE COMPOUNDS Merck & Co., Inc. (US) 2004-09-01 EP claimed
WO-2003045920-A1 4-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-20050009815-A1 4-Aminoquinoline compounds MCHR1, MCHR2, MC5R MCHR1 1/4885TP53 3217/4885MAPT 547/4885

“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.