SCHEMBL28274584

SCHEMBL28274584

CN(C(=O)Oc1ccccc1)[C@H](CO)C1(O)CC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPY5R Q15761 1/20 0.47
ATM Q13315 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
SLC6A2 P23975 1/20 0.40
SLC6A4 P31645 1/20 0.40
SLC6A3 Q01959 1/20 0.40
AADAT Q8N5Z0 1/20 0.40
BCHE P06276 4/20 0.39
ACHE P22303 4/20 0.39
ALDH1A1 P00352 2/20 0.39
KMT2A Q03164 2/20 0.39
PKM P14618 1/20 0.39
RAB9A P51151 4/20 0.38
SMN1; SMN2 Q16637 3/20 0.37
NPC1 O15118 2/20 0.37
LMNA P02545 2/20 0.37
CHRM2 P08172 1/20 0.37
CHRM1 P11229 1/20 0.37
CHRM3 P20309 1/20 0.37

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
SCHEMBL28050405 0.72 NPY5R (0.53) NPY5RATMTDP1L3MBTL1BCHE
SCHEMBL3475218 0.72 NPY5R (0.59) NPY5RATMTDP1L3MBTL1BCHE
SCHEMBL28050443 0.71 NPY5R (0.52) NPY5RATMTDP1L3MBTL1BCHE
SCHEMBL28050440 0.71 NPY5R (0.52) NPY5RATMTDP1L3MBTL1BCHE
SCHEMBL28050399 0.71 NPY5R (0.52) NPY5RATMTDP1L3MBTL1BCHE
SCHEMBL9623297 0.71 NPY5R (0.51) NPY5RATMTDP1L3MBTL1BCHE
SCHEMBL5370760 0.70 NPY5R (0.57) NPY5RATMTDP1L3MBTL1BCHE
SCHEMBL9735895 0.69 NPY5R (0.56) NPY5RATMTDP1L3MBTL1AADAT
SCHEMBL9735897 0.69 NPY5R (0.56) NPY5RATMTDP1L3MBTL1AADAT
SCHEMBL5804088 0.69 NPY5R (0.49) NPY5RATMTDP1L3MBTL1BCHE

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
CN-105164117-B Dipeptides and tripeptide epoxy ketone protease inhibitors 欧尼斯治疗公司 2019-02-01 CN disclosed