SCHEMBL6252228

SCHEMBL6252228

O=C1CCCCCN1Cc1ccccc1N1CC[N]CC1

nearest known ligand 0.55

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.54
ADRA1D P25100 3/20 0.46
ADRA1A P35348 3/20 0.46
ACHE P22303 1/20 0.45
HRH3 Q9Y5N1 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
SCHEMBL6253311 0.99 L3MBTL1 (0.51) L3MBTL1ADRA1DADRA1AACHE
SCHEMBL6253602 0.95 ADRA1B (0.47) L3MBTL1ADRA1DADRA1A
SCHEMBL6249596 0.84 L3MBTL1 (0.54) L3MBTL1ADRA1DADRA1AACHE
SCHEMBL6111104 0.83 L3MBTL1 (0.51) L3MBTL1ADRA1DADRA1AACHE
SCHEMBL14458720 0.81 ADRA1B (0.49) L3MBTL1ADRA1DADRA1A
SCHEMBL14458725 0.78 ADRA1B (0.47) L3MBTL1ADRA1DADRA1A
SCHEMBL5561359 0.78 HTR1A (0.48) L3MBTL1ADRA1DADRA1AACHE
SCHEMBL6252224 0.77 L3MBTL1 (0.51) L3MBTL1ACHEHRH3
SCHEMBL1111741 0.76 ALDH1A1 (0.47)
SCHEMBL6251892 0.75 L3MBTL1 (0.49) L3MBTL1ACHEHRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2005054278-A1 SUBSTITUTED N-BENZYL-LACTAM DERIVATIVES AS MELANOCORTIN-4 RECEPTOR AGONISTS SANTHERA PHARMACEUTICALS (SCHWEIZ) GMBH (CH) 2005-06-16 WO disclosed