SCHEMBL5416495

SCHEMBL5416495

CCN(CC(C1CCCCC1)N1CCN(C(=O)[CH]Cc2ccc(Cl)cc2)CC1)S(=O)(=O)C(N)=O

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MC4R P32245 10/20 0.51
KMT2A Q03164 1/20 0.37
GAA P10253 1/20 0.35
ALDH1A1 P00352 1/20 0.34
CNR1 P21554 2/20 0.33
NPSR1 Q6W5P4 1/20 0.33

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
SCHEMBL5414668 0.99 MC4R (0.49) MC4RKMT2AGAAALDH1A1CNR1
SCHEMBL5414706 0.87 MC4R (0.43) MC4RKMT2AALDH1A1CNR1NPSR1
SCHEMBL5403095 0.84 MC4R (0.48) MC4RALDH1A1CNR1
SCHEMBL5411103 0.84 MC4R (0.48) MC4RALDH1A1CNR1
SCHEMBL5406153 0.83 MC4R (0.47) MC4RKMT2AALDH1A1CNR1
SCHEMBL5411342 0.78 MC4R (0.49) MC4R
SCHEMBL5416498 0.76 MC4R (0.70) MC4RGAA
Hydrochloric Acid SCHEMBL5411357 0.75 MC4R (0.69) MC4RGAA
SCHEMBL5414672 0.75 MC4R (0.69) MC4R
Hydrochloric Acid SCHEMBL7154420 0.74 MC4R (0.59) MC4R

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-7169777-B2 Melanocortin receptor agonists ELI LILLY AND COMPANY (US) 2007-01-30 US disclosed
US-20040116699-A1 Melanocortin receptor agonists ELI LILLY AND COMPANY 2004-06-17 US disclosed
EP-1358163-A1 MELANOCORTIN RECEPTOR AGONISTS ELI LILLY AND COMPANY (US) 2003-11-05 EP disclosed
WO-2002059095-A1 MELANOCORTIN RECEPTOR AGONISTS ELI LILLY AND COMPANY (US) 2002-08-01 WO disclosed