SCHEMBL26879069

SCHEMBL26879069

CC(=O)[C@@H](NC(=O)[C@H](CC1CCCCC1)NC(=O)[C@H](CCN)NC(=O)[C@H](C)CC(C)C)C(C)C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CPB2 Q96IY4 11/20 0.47
▸ REN P00797 1/20 0.40
▸ PSMB11 A5LHX3 1/20 0.38
▸ PSMA7 O14818 1/20 0.38
▸ PSMB1 P20618 1/20 0.38
▸ PSMA1 P25786 1/20 0.38
▸ PSMA2 P25787 1/20 0.38
▸ PSMA3 P25788 1/20 0.38
▸ PSMA4 P25789 1/20 0.38
▸ PSMB8 P28062 1/20 0.38
▸ PSMB9 P28065 1/20 0.38
▸ PSMA5 P28066 1/20 0.38
▸ PSMB4 P28070 1/20 0.38
▸ PSMB6 P28072 1/20 0.38
▸ PSMB5 P28074 1/20 0.38
▸ LONP1 P36776 1/20 0.38
▸ PSMB10 P40306 1/20 0.38
▸ PSMB3 P49720 1/20 0.38
▸ PSMB2 P49721 1/20 0.38
▸ PSMA6 P60900 1/20 0.38

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
SCHEMBL26873245 0.93 CPB2 (0.46) CPB2RENPSMB11PSMA7PSMB1
SCHEMBL26903709 0.91 CPB2 (0.45) CPB2RENPSMB11PSMA7PSMB1
SCHEMBL26174178 0.91 CPB2 (0.48) CPB2CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL26169926 0.85 CPB2 (0.44) CPB2RENCHRNB2CHRNB4CHRNA3
SCHEMBL26172465 0.84 CPB2 (0.47) CPB2CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL27342709 0.81 CPB2 (0.42) CPB2MMP3MMP1MMP2
SCHEMBL24916226 0.81 CPB2 (0.53) CPB2CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL26174195 0.81 CPB2 (0.43) CPB2CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL26169977 0.80 CPB2 (0.44) CPB2CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL26172314 0.79 CPB2 (0.47) CPB2MMP3CHRNB2CHRNB4CHRNA3

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-2023225661-A1 MACROCYCLIC IMMUNOMODULATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2023-11-23 — — WO disclosed
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