SCHEMBL25839541

SCHEMBL25839541

COCC(=O)NCC(=O)NCC(=O)NC(Cc1ccccc1)C(=O)NCC(C)=O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PSMB5 P28074 3/20 0.53
▸ OPRD1 P41143 6/20 0.50
▸ OPRM1 P35372 5/20 0.50
▸ OPRK1 P41145 2/20 0.50
▸ CTSS P25774 3/20 0.49
▸ CTSL P07711 2/20 0.49
▸ CTSB P07858 2/20 0.49
▸ REN P00797 1/20 0.48
▸ CTSK P43235 2/20 0.48
▸ PSMB11 A5LHX3 2/20 0.48
▸ PSMA7 O14818 2/20 0.48
▸ PSMB1 P20618 2/20 0.48
▸ PSMA1 P25786 2/20 0.48
▸ PSMA2 P25787 2/20 0.48
▸ PSMA3 P25788 2/20 0.48
▸ PSMA4 P25789 2/20 0.48
▸ PSMB8 P28062 2/20 0.48
▸ PSMB9 P28065 2/20 0.48
▸ PSMA5 P28066 2/20 0.48
▸ PSMB4 P28070 2/20 0.48

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
SCHEMBL24774075 0.87 OPRD1 (0.53) OPRD1OPRM1OPRK1CTSSCTSL
SCHEMBL25774591 0.87 OPRD1 (0.53) OPRD1OPRM1OPRK1CTSSCTSL
SCHEMBL25148131 0.87 OPRD1 (0.53) OPRD1OPRM1OPRK1CTSSCTSL
SCHEMBL24774070 0.85 OPRD1 (0.53) OPRD1OPRM1OPRK1CTSSCTSL
SCHEMBL24760306 0.85 OPRD1 (0.53) OPRD1OPRM1OPRK1CTSSCTSL
SCHEMBL25046490 0.83 OPRD1 (0.49) OPRD1OPRM1OPRK1CTSSCTSL
SCHEMBL24760230 0.83 CTSS (0.55) OPRD1OPRM1OPRK1CTSSCTSL
SCHEMBL15806582 0.81 OPRD1 (0.51) PSMB5OPRD1OPRM1OPRK1CTSB
SCHEMBL25148144 0.81 FAAH (0.56) PSMB5OPRD1OPRM1CTSB
SCHEMBL23937555 0.80 CTSS (0.55) OPRD1OPRM1OPRK1CTSSCTSL

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-2023137026-A1 CAMPTOTHECIN ANALOGS CONJUGATED TO A GLUTAMINE RESIDUE IN A PROTEIN, AND THEIR USE REGENERON PHARMACEUTICALS, INC. (US) 2023-07-20 — — WO disclosed
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