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SCHEMBL14478103

SCHEMBL14478103

NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)CCC(=O)O

nearest known ligand 0.60

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ APC P25054 3/20 0.60
▸ OPRD1 P41143 8/20 0.53
▸ OPRM1 P35372 7/20 0.53
▸ OPRK1 P41145 3/20 0.53
▸ CCKBR P32239 3/20 0.51
▸ NPY1R P25929 1/20 0.49
▸ NPY2R P49146 1/20 0.49
▸ NPY4R P50391 1/20 0.49
▸ NPY5R Q15761 1/20 0.49
▸ GRIA1 P42261 1/20 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
SCHEMBL14478149 0.95 APC (0.54) APC
SCHEMBL14478105 0.90 OPRD1 (0.57) APCOPRD1CCKBR
SCHEMBL14478152 0.89 APC (0.51) APCOPRD1OPRM1OPRK1CCKBR
SCHEMBL15788809 0.83 CHRND (0.59) NPY1RNPY2RNPY4RNPY5RGRIA1
SCHEMBL14122653 0.83 MMP2 (0.64) APCGRIA1
SCHEMBL19112074 0.83 MMP2 (0.64) APCGRIA1
SCHEMBL6868740 0.83 MMP2 (0.64) APCGRIA1
SCHEMBL29540311 0.82 NAALAD2 (0.59) APCOPRD1OPRM1OPRK1
SCHEMBL25627431 0.81 APC (0.52) APCNPY1RNPY2RNPY4RNPY5R
SCHEMBL14478026 0.81 LCK (0.53) APCOPRD1OPRM1CCKBR

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-2013001297-A1 BINDING INHIBITORS OF THE BETA.TRANSDUCIN REPEAT - CONTAINING PROTEIN ITI SCOTLAND LIMITED (GB) 2013-01-03 — — WO disclosed
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