SCHEMBL27668367

SCHEMBL27668367

NC(=O)c1cccnc1OCc1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.58
CNR2 P34972 4/20 0.57
CNR1 P21554 3/20 0.57
RAB9A P51151 2/20 0.51
POLB P06746 1/20 0.51
SIRT2 Q8IXJ6 2/20 0.50
ROCK2 O75116 1/20 0.50
PARP10 Q53GL7 1/20 0.50
PARP1 P09874 1/20 0.50
TSHR P16473 1/20 0.48
CASP3 P42574 1/20 0.48
SENP8 Q96LD8 1/20 0.48
SENP7 Q9BQF6 1/20 0.48
SENP6 Q9GZR1 1/20 0.48
ALDH1A1 P00352 1/20 0.48
LTA4H P09960 1/20 0.47
MAPK14 Q16539 1/20 0.47
MAPK8 P45983 1/20 0.47
SGMS2 Q8NHU3 1/20 0.47
HTT P42858 1/20 0.47

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
SCHEMBL6302868 0.87 L3MBTL1 (0.52) L3MBTL1CNR2CNR1RAB9APOLB
SCHEMBL3604199 0.87 L3MBTL1 (0.61) L3MBTL1CNR2CNR1RAB9APOLB
SCHEMBL15132068 0.84 L3MBTL1 (0.62) L3MBTL1CNR2CNR1RAB9APOLB
SCHEMBL5812840 0.82 CNR2 (0.59) L3MBTL1CNR2CNR1ALDH1A1MAPK8
SCHEMBL11546388 0.80 L3MBTL1 (0.45) L3MBTL1CNR2CNR1RAB9APOLB
SCHEMBL11549943 0.80 RPS6KB1 (0.52) CNR2CNR1POLBMAPK8RPS6KB1
SCHEMBL11546391 0.79 L3MBTL1 (0.60) L3MBTL1TSHRALDH1A1MAPK8HTT
SCHEMBL3514563 0.79 CNR2 (0.56) L3MBTL1CNR2CNR1RAB9AALDH1A1
SCHEMBL11199728 0.79 RAB9A (0.55) L3MBTL1RAB9AROCK2PARP1ALDH1A1
SCHEMBL6302948 0.79 RAB9A (0.55) L3MBTL1RAB9AROCK2PARP1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1906155-A Novel hydroxamic acid esters and pharmaceutical use thereof LEO PHARMA AS (DK) 2007-01-31 CN claimed
CN-1906155-A Novel hydroxamic acid esters and pharmaceutical use thereof LEO PHARMA AS (DK) 2007-01-31 CN disclosed