SCHEMBL14593448

SCHEMBL14593448

CCN(CC)CC(c1ccccc1OC)N1CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.65

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MC4R P32245 11/20 0.65
ABCB1 P08183 1/20 0.43
CHRM2 P08172 1/20 0.40
CHRM4 P08173 1/20 0.40
CHRM1 P11229 1/20 0.40
CHRM3 P20309 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
BCHE P06276 1/20 0.40
ACHE P22303 1/20 0.40
GLS O94925 1/20 0.40

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
SCHEMBL14593447 0.87 MC4R (0.63) MC4RCHRM2CHRM4CHRM1CHRM3
SCHEMBL5413611 0.87 MC4R (0.63) MC4R
SCHEMBL5411133 0.87 MC4R (0.63) MC4RCHRM2CHRM4CHRM1CHRM3
SCHEMBL14593354 0.85 MC4R (0.66) MC4RCHRM2CHRM4CHRM1CHRM3
SCHEMBL5406356 0.85 MC4R (0.66) MC4RCHRM2CHRM4CHRM1CHRM3
SCHEMBL14593418 0.84 MC4R (0.60) MC4RABCB1CHRM2CHRM4CHRM1
SCHEMBL14593237 0.84 ABCB1 (0.45) MC4RABCB1CHRM2CHRM4CHRM1
SCHEMBL14593313 0.82 ALDH1A1 (0.49) MC4R
SCHEMBL14593267 0.81 MC4R (0.64) MC4R
SCHEMBL14593321 0.81 MC4R (0.55) MC4RABCB1CHRM2CHRM4CHRM1

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
US-7169777-B2 Melanocortin receptor agonists ELI LILLY AND COMPANY (US) 2007-01-30 US disclosed