SCHEMBL4054020

SCHEMBL4054020

CN(C)S(=O)(=O)c1cccc(-c2ccnc3cc(-c4ccncc4)nn23)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRAF P15056 7/20 0.51
NPC1 O15118 2/20 0.49
RAB9A P51151 2/20 0.49
LMNA P02545 2/20 0.49
MAPT P10636 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
HTT P42858 1/20 0.48
ALDH1A1 P00352 4/20 0.46
KDM4E B2RXH2 3/20 0.46
KCNH2 Q12809 2/20 0.46
HPGD P15428 2/20 0.46
GFER P55789 2/20 0.46
GLA P06280 1/20 0.46
GAA P10253 1/20 0.46
MAPK1 P28482 1/20 0.46
RXFP1 Q9HBX9 1/20 0.46
FYN P06241 4/20 0.45
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
HSD17B10 Q99714 2/20 0.45

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
SCHEMBL7430043 0.78 ALDH1A1 (0.57) NPC1RAB9ALMNAL3MBTL1ALDH1A1
SCHEMBL4050893 0.78 PI4KB (0.41) BRAFNPC1RAB9ALMNAL3MBTL1
SCHEMBL4655958 0.77 MAPT (0.57) BRAFNPC1RAB9ALMNAMAPT
SCHEMBL4056069 0.77 BRAF (0.56) BRAFFYN
SCHEMBL4655911 0.74 MAPT (0.62) BRAFNPC1RAB9ALMNAMAPT
SCHEMBL4059789 0.73 BRAF (0.51) BRAFFYN
SCHEMBL4058317 0.73 BRAF (0.57) BRAFMAPTALDH1A1FYN
SCHEMBL4655734 0.72 BRAF (0.75) BRAFFYN
SCHEMBL4760925 0.70 BRAF (0.81) BRAFNPC1RAB9ALMNAMAPT
SCHEMBL4657215 0.70 BRAF (0.66) BRAFNPC1RAB9AMAPTALDH1A1

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
WO-2009111260-A1 PHENYLSULFONAMIDE-SUBSTITUTED, PYRAZOLO[1, 5-A]PYRIMIDINES, METHODS FOR PREPARATION AND USES THEREOF WYETH (US) 2009-09-11 WO disclosed