SCHEMBL18716997

SCHEMBL18716997

CC(=O)NCCC[C@@H]1NC(=O)C(NC(=O)[C@H](CCCNC(=N)N)NC(C)=O)CCC(=O)NCCCC(C(N)=O)NC(=O)[C@H](C)NC(=O)CNC(=O)C(Cc2ccccc2)NC1=O

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MC4R P32245 9/20 0.53
▸ FURIN P09958 1/20 0.51
▸ FCGRT P55899 1/20 0.46
▸ MC5R P33032 2/20 0.46
▸ MC3R P41968 2/20 0.46
▸ MC1R Q01726 2/20 0.46
▸ PLK1 P53350 1/20 0.45
▸ KEAP1 Q14145 1/20 0.45
▸ SIRT2 Q8IXJ6 1/20 0.45
▸ SIRT1 Q96EB6 1/20 0.45
▸ SIRT3 Q9NTG7 1/20 0.45

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
SCHEMBL20642726 0.96 MC4R (0.54) MC4RFURINFCGRTMC5RMC3R
SCHEMBL18716979 0.94 MC4R (0.59) MC4RFURINFCGRTMC5RMC3R
SCHEMBL18716994 0.92 MC4R (0.53) MC4RFURINFCGRTMC5RMC3R
SCHEMBL20642818 0.91 MC4R (0.59) MC4RFURINFCGRTMC5RMC3R
SCHEMBL20642717 0.90 FCGRT (0.52) MC4RFURINFCGRTMC5RMC3R
SCHEMBL20642765 0.90 MC4R (0.50) MC4RFURINKEAP1
SCHEMBL19473946 0.90 MC4R (0.53) MC4RFURINFCGRTKEAP1
SCHEMBL19473950 0.90 MC4R (0.61) MC4RFURINMC5RMC3RMC1R
SCHEMBL19473857 0.89 MC4R (0.58) MC4RFURINMC5RMC3RMC1R
SCHEMBL19474002 0.89 SIRT2 (0.48) MC4RFURINMC3RSIRT2SIRT1

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
EP-2440572-B1 LACTAM-BRIDGED MELANOCORTIN RECEPTOR-SPECIFIC PEPTIDES PALATIN TECHNOLOGIES INC (US) 2017-04-05 — — EP disclosed
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