SCHEMBL8945519

SCHEMBL8945519

Oc1nc(S)nc2ccsc12

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
AXL P30530 1/20 0.37
MKNK1 Q9BUB5 1/20 0.37
MKNK2 Q9HBH9 1/20 0.37
ADORA2A P29274 12/20 0.34
ADORA1 P30542 10/20 0.34
HTT P42858 1/20 0.34
MAPT P10636 2/20 0.33
PIK3CA P42336 1/20 0.33
MTOR P42345 1/20 0.33
RAB9A P51151 2/20 0.32
NPC1 O15118 1/20 0.32
ADORA3 P0DMS8 1/20 0.32
ADORA2B P29275 1/20 0.32
ELANE P08246 1/20 0.32
HCRTR1 O43613 1/20 0.32
ALOX15 P16050 1/20 0.32
TSHR P16473 1/20 0.32
MAPK1 P28482 1/20 0.32
HSD17B10 Q99714 1/20 0.32

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
SCHEMBL55302 0.79 AXL (0.39) AXLMKNK1MKNK2ADORA2AADORA1
SCHEMBL29893499 0.79 AXL (0.39) AXLMKNK1MKNK2ADORA2AADORA1
SCHEMBL4714518 0.72 ADORA2A (0.56) AXLMKNK1MKNK2ADORA2AADORA1
SCHEMBL8363046 0.72 ADORA2A (0.42) AXLMKNK1MKNK2ADORA2AADORA1
SCHEMBL9381944 0.72 ADORA2A (0.56) ADORA2AADORA1ADORA3ADORA2BELANE
SCHEMBL18701478 0.72 ADORA2A (0.56) AXLMKNK1MKNK2ADORA2AADORA1
SCHEMBL8945303 0.72 HTT (0.61) AXLMKNK1MKNK2ADORA2AADORA1
SCHEMBL7121620 0.71 PDE4A (0.55) ADORA2AADORA1HTTMAPTPIK3CA
SCHEMBL14095091 0.69 PDE4A (0.52) ADORA2AADORA1PIK3CAMTOR
SCHEMBL14095195 0.69 ADORA2A (0.50) ADORA2AADORA1HTTMAPTADORA3

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
US-5494887-A Ring annulated 5-alkoxy-n-aryl[1,2,4]triazolo[1,5-C]-pyrimidine-2-sulfonamide herbicides DOWELANCO (US) 1996-02-27 US disclosed