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SCHEMBL24012364

SCHEMBL24012364

Cc1c(CC(=O)NCCCOCCOCCOCCCNC(=O)c2ccc3nonc3c2)c(=O)oc2cc(NCC(=O)NCCOCCOCCOCCOCCC(=O)ON3C(=O)CCC3=O)ccc12

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ PSMB8 P28062 2/20 0.35
▸ PSMB5 P28074 1/20 0.35
▸ CDYL Q9Y232 1/20 0.34
▸ NPC1 O15118 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ NCOA1 Q15788 1/20 0.33
▸ NCOA3 Q9Y6Q9 1/20 0.33
▸ DRD3 P35462 6/20 0.33
▸ KMT2A Q03164 4/20 0.33
▸ MEN1 O00255 3/20 0.33
▸ DRD2 P14416 3/20 0.32

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
SCHEMBL21806175 0.90 NPC1 (0.38) CDYLNPC1RAB9ANCOA1NCOA3
SCHEMBL24012424 0.86 CDYL (0.39) CDYLRAB9ADRD3KMT2AMEN1
SCHEMBL21806242 0.85 CDYL (0.40) CDYLNPC1RAB9ANCOA1NCOA3
SCHEMBL21806226 0.84 CDYL (0.38) CDYLNPC1RAB9ANCOA1NCOA3
SCHEMBL21806086 0.79 CDYL (0.42) CDYLRAB9ADRD3KMT2AMEN1
SCHEMBL13056381 0.78 ADORA3 (0.43) NPC1RAB9ADRD3DRD2
SCHEMBL13248221 0.77 ADORA3 (0.44) NPC1RAB9ADRD3DRD2
SCHEMBL21806248 0.75 CA12 (0.40) DRD3DRD2
SCHEMBL1264617 0.70 SRC (0.46) PSMB8PSMB5CDYLNPC1RAB9A
SCHEMBL19465283 0.67 GLP1R (0.38) PSMB8PSMB5CDYLNPC1RAB9A

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-20210349101-A1 COUMARIN-BASED CROSSLINKING REAGENTS VENTANA MEDICAL SYSTEMS, INC. 2021-11-11 — — US disclosed
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