SCHEMBL19683185

SCHEMBL19683185

CCCCCC(=O)NC(Cc1ccc(OC(=O)CN2CCCC2)cc1)C(=O)NC(C(=O)NC(C)(C)C(C)(CC)C(N)=O)C(C)CC

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ ITGB3 P05106 2/20 0.37
▸ ITGA2B P08514 2/20 0.37
▸ CTSD P07339 2/20 0.36
▸ ACE P12821 3/20 0.36
▸ ACE2 Q9BYF1 3/20 0.36
▸ PTPN1 P18031 1/20 0.36
▸ PSMB5 P28074 3/20 0.36
▸ AGTR1 P30556 2/20 0.35
▸ GRIA1 P42261 1/20 0.34
▸ CACNA1B Q00975 1/20 0.34
▸ PSMB8 P28062 1/20 0.34
▸ PSMB9 P28065 1/20 0.34
▸ PSMB10 P40306 1/20 0.34
▸ PSMB2 P49721 1/20 0.34
▸ BCL2 P10415 1/20 0.34
▸ STAT3 P40763 1/20 0.34
▸ ANPEP P15144 1/20 0.34
▸ LNPEP Q9UIQ6 1/20 0.34

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
SCHEMBL23425701 0.89 CTSD (0.37) ITGB3ITGA2BCTSDACEACE2
SCHEMBL24276205 0.87 CTSD (0.37) ITGB3ITGA2BCTSDACEACE2
SCHEMBL19682986 0.86 ITGB3 (0.38) ITGB3ITGA2BCTSDACEACE2
SCHEMBL19683064 0.85 MMP12 (0.42) ITGB3ITGA2BPSMB5CACNA1BPSMB8
SCHEMBL19683183 0.85 ITGB3 (0.40) ITGB3ITGA2BCTSDPTPN1PSMB5
SCHEMBL19683214 0.84 GRIA1 (0.46) ITGB3ITGA2BCTSDGRIA1
SCHEMBL23425671 0.84 ITGB3 (0.36) ITGB3ITGA2BCTSDACEACE2
SCHEMBL19682988 0.83 MMP12 (0.40) PSMB5CACNA1BPSMB8PSMB9PSMB10
SCHEMBL24276124 0.81 MMP12 (0.42) PSMB5CACNA1BPSMB8PSMB9PSMB10
SCHEMBL19683066 0.81 ITGB3 (0.36) ITGB3ITGA2BCTSDPTPN1PSMB5

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-2017210489-A1 COMPOUNDS M3 BIOTECHNOLOGY, INC. (US) 2017-12-07 — — WO disclosed
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