SCHEMBL3261384

SCHEMBL3261384

CCOC(=O)c1c(Cc2ccc(Cl)cc2)[nH][nH]c1=O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.57
MAPT P10636 3/20 0.57
TP53 P04637 2/20 0.57
NPC1 O15118 1/20 0.57
RAB9A P51151 1/20 0.57
ALOX5 P09917 7/20 0.56
PTGES O14684 1/20 0.53
NPSR1 Q6W5P4 3/20 0.50
KDM4E B2RXH2 1/20 0.50
ALDH1A1 P00352 1/20 0.50
TNF P01375 1/20 0.50
HSP90AA1 P07900 1/20 0.50
HPGD P15428 1/20 0.50
ALOX12 P18054 1/20 0.50
CCR6 P51684 1/20 0.50
RUNX1 Q01196 1/20 0.50
CBFB Q13951 1/20 0.50
HKDC1 Q2TB90 1/20 0.50
NOD2 Q9HC29 1/20 0.50
GPR35 Q9HC97 1/20 0.50

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
SCHEMBL3262242 0.86 SMN1; SMN2 (0.56) LMNAMAPTNPC1RAB9AALOX5
SCHEMBL1659952 0.76 CYP1A2 (0.49) LMNAMAPTNPSR1KDM4EALDH1A1
SCHEMBL11811537 0.75 LMNA (0.55) LMNAMAPTTP53NPC1RAB9A
SCHEMBL3263160 0.74 LMNA (0.53) LMNAMAPTTP53NPC1RAB9A
SCHEMBL7675758 0.74 ALOX5 (0.55) LMNAMAPTTP53NPC1RAB9A
SCHEMBL7675763 0.71 ALOX5 (0.51) LMNAMAPTTP53NPC1RAB9A
SCHEMBL22272868 0.70 LMNA (0.54) LMNAMAPTTP53NPC1RAB9A
SCHEMBL27294436 0.70 PRKCZ (0.54) LMNAMAPTTP53NPC1RAB9A
SCHEMBL4558554 0.69 ALOX5 (1.00) ALOX5PTGES
SCHEMBL11273877 0.69 CSF1R (0.49) 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