SCHEMBL3263136

SCHEMBL3263136

Cc1c(-c2ccncc2)c(=O)[nH]n1-c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.55
NPC1 O15118 2/20 0.55
RAB9A P51151 2/20 0.55
MITF O75030 1/20 0.55
KMT2A Q03164 6/20 0.52
LMNA P02545 4/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
GAA P10253 5/20 0.49
ALOX15 P16050 1/20 0.49
LDHA P00338 1/20 0.43
KDM4E B2RXH2 3/20 0.43
TSHR P16473 1/20 0.42
MEN1 O00255 4/20 0.41
ALDH1A1 P00352 1/20 0.40
MAPK14 Q16539 1/20 0.40
SLC11A2 P49281 1/20 0.40
HTT P42858 4/20 0.39
GFER P55789 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
IMPDH2 P12268 1/20 0.39

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
SCHEMBL3261266 0.89 GAA (0.60) MAPTNPC1RAB9AMITFKMT2A
SCHEMBL3265584 0.84 NPC1 (0.51) MAPTNPC1RAB9AMITFKMT2A
SCHEMBL7753154 0.73 TSHR (0.53) MAPTNPC1RAB9AMITFKMT2A
SCHEMBL4775831 0.73 KMT2A (0.51) MAPTNPC1RAB9AKMT2ALMNA
SCHEMBL11050609 0.70 GAA (0.53) MAPTNPC1RAB9AMITFKMT2A
SCHEMBL7656234 0.69 ALDH1A1 (0.53) MAPTNPC1RAB9AKMT2ALMNA
SCHEMBL3259617 0.68 DHFR (0.51) MAPTKMT2ALMNAGAAALOX15
SCHEMBL11003374 0.68 TSHR (0.47) MAPTNPC1RAB9AMITFKMT2A
SCHEMBL14879550 0.67 TSHR (0.46) MAPTNPC1RAB9AMITFKMT2A
SCHEMBL23399618 0.66 GAA (1.00) MAPTNPC1RAB9AKMT2ALMNA

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 4 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
EP-2151433-A1 Alkoxypyrazoles and the process for their preparation Institut Pasteur (FR) 2010-02-10 EP disclosed
EP-2151433-A1 Alkoxypyrazoles and the process for their preparation Institut Pasteur (FR) 2010-02-10 EP disclosed