SCHEMBL16217879

SCHEMBL16217879

CCN[C@@H](Cc1ccc(O)cc1)C(=O)NCC(C)=O

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ GRIA1 P42261 2/20 0.44
▸ CTSL P07711 1/20 0.44
▸ OPRD1 P41143 5/20 0.44
▸ OPRM1 P35372 4/20 0.44
▸ OPRK1 P41145 1/20 0.44
▸ FOLH1 Q04609 1/20 0.44
▸ CHRND Q07001 5/20 0.44
▸ CHRNA1 P02708 1/20 0.44
▸ CHRNG P07510 1/20 0.44
▸ CHRNB1 P11230 1/20 0.44
▸ MME P08473 1/20 0.43
▸ ACE P12821 1/20 0.43
▸ CPA1 P15085 1/20 0.43
▸ ACE2 Q9BYF1 1/20 0.43

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
SCHEMBL24476234 0.87 CTSS (0.51) CTSLMMEACE
SCHEMBL27334440 0.87 CTSS (0.51) CTSLMMEACE
SCHEMBL19700517 0.86 FOLH1 (0.45) GRIA1CTSLOPRD1OPRM1OPRK1
SCHEMBL16217709 0.85 GRIA1 (0.46) GRIA1CTSLOPRD1OPRM1OPRK1
SCHEMBL21415384 0.85 GRIA1 (0.46) GRIA1CTSLOPRD1OPRM1OPRK1
SCHEMBL16656679 0.85 GRIA1 (0.46) GRIA1CTSLOPRD1OPRM1OPRK1
SCHEMBL15095619 0.82 ESR1 (0.53) FOLH1MMEACECPA1ACE2
SCHEMBL15336553 0.82 ESR1 (0.53) FOLH1MMEACECPA1ACE2
SCHEMBL9968605 0.80 OPRD1 (0.55) GRIA1CTSLOPRD1OPRM1OPRK1
SCHEMBL18973023 0.79 ESR1 (0.44) OPRK1MMEACECPA1ACE2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2015168618-A2 COMPOSITIONS AND METHODS FOR MODULATING GROWTH HORMONE RECEPTOR EXPRESSION ISIS PHARMACEUTICALS, INC. (US) 2015-11-05 — — WO disclosed
WO-2014179620-A1 CONJUGATED ANTISENSE COMPOUNDS AND THEIR USE ISIS PHARMACEUTICALS, INC. (US) 2014-11-06 — — WO disclosed
WO-2014179625-A1 COMPOSITIONS AND METHODS FOR MODULATING APOLIPOPROTEIN (a) EXPRESSION ISIS PHARMACEUTICALS, INC. (US) 2014-11-06 — — WO disclosed
WO-2014179629-A2 COMPOSITIONS AND METHODS ISIS PHARMACEUTICALS, INC. (US) 2014-11-06 — — WO disclosed
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