SCHEMBL18568248

SCHEMBL18568248

CC(C)C(NC(=O)C(Cc1ccccc1)NC(=O)C(NC(=O)C1CCCN1)C(C)C)C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ CALCRL Q16602 1/20 0.56
▸ CTSC P53634 2/20 0.54
▸ REN P00797 5/20 0.51
▸ BACE1 P56817 1/20 0.49
▸ HLA-DRB1 P01911 1/20 0.47
▸ CTSD P07339 1/20 0.45
▸ GHSR Q92847 1/20 0.44
▸ KMT2A Q03164 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
SCHEMBL8953885 1.00 CALCRL (0.56) CALCRLCTSCRENBACE1HLA-DRB1
SCHEMBL9642398 1.00 CALCRL (0.56) CALCRLCTSCRENBACE1HLA-DRB1
SCHEMBL30053097 0.95 CTSC (0.57) CALCRLCTSCRENBACE1HLA-DRB1
SCHEMBL30051514 0.93 CTSC (0.57) CALCRLCTSCRENBACE1KMT2A
SCHEMBL30239995 0.89 CTSC (0.52) CALCRLCTSCRENBACE1HLA-DRB1
SCHEMBL9179033 0.89 CTSC (0.53) CALCRLCTSCRENBACE1HLA-DRB1
SCHEMBL29433973 0.88 CALCRL (0.56) CALCRLCTSCRENBACE1CTSD
SCHEMBL10618815 0.87 CTSC (0.56) CALCRLCTSCRENBACE1GHSR
SCHEMBL10618805 0.87 CTSC (0.56) CALCRLCTSCRENBACE1GHSR
SCHEMBL30186417 0.87 CTSC (0.55) CALCRLCTSCRENBACE1GHSR

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-9586989-B1 Non-toxic skin cancer therapy with copper peptides SKIN BIOLOGY, INC. (US) 2017-03-07 — — US disclosed
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