SCHEMBL3263160

SCHEMBL3263160

CCOC(=O)c1c(OCC)n[nH]c1Cc1ccc(Cl)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 6/20 0.53
MAPT P10636 5/20 0.53
TP53 P04637 2/20 0.53
NPC1 O15118 2/20 0.53
RAB9A P51151 2/20 0.53
ALOX5 P09917 4/20 0.52
PTGES O14684 1/20 0.49
NPSR1 Q6W5P4 3/20 0.46
MAPK1 P28482 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
HTT P42858 1/20 0.46
ALPL P05186 1/20 0.45
ALDH1A1 P00352 2/20 0.44
KDM4E B2RXH2 1/20 0.44
TNF P01375 1/20 0.44
HSP90AA1 P07900 1/20 0.44
HPGD P15428 1/20 0.44
ALOX12 P18054 1/20 0.44
CCR6 P51684 1/20 0.44
RUNX1 Q01196 1/20 0.44

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
SCHEMBL3262663 0.88 SMN1; SMN2 (0.51) LMNAMAPTNPC1RAB9AALOX5
SCHEMBL3261384 0.74 LMNA (0.57) LMNAMAPTTP53NPC1RAB9A
SCHEMBL3260996 0.72 PDE4D (0.69) MAPTNPSR1MAPK1HTTALDH1A1
SCHEMBL13495321 0.72 SMN1; SMN2 (0.53) LMNAMAPTNPC1RAB9AALOX5
SCHEMBL6228465 0.72 KMT2A (0.51) LMNAMAPTNPC1RAB9AALOX5
SCHEMBL3265324 0.71 PDE4D (0.53) MAPTNPSR1MAPK1HTTALDH1A1
SCHEMBL25382643 0.71 SMN1; SMN2 (0.52) LMNAMAPTNPC1RAB9AALOX5
SCHEMBL20897262 0.71 ALPL (0.64) LMNAMAPTTP53NPC1RAB9A
SCHEMBL7828097 0.71 LMNA (0.50) LMNAMAPTTP53NPC1RAB9A
SCHEMBL7675758 0.71 ALOX5 (0.55) LMNAMAPTTP53NPC1RAB9A

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
WO-2010015657-A2 NEW ALKOXYPYRAZOLES INSTITUT PASTEUR (FR) 2010-02-11 WO disclosed
WO-2010015657-A2 NEW ALKOXYPYRAZOLES INSTITUT PASTEUR (FR) 2010-02-11 WO disclosed