SCHEMBL9852151

SCHEMBL9852151

O=C(O)Nc1nc(-c2ccc(Cl)cc2)ns1

nearest known ligand 0.75

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 7/20 0.75
LMNA P02545 7/20 0.75
NPC1 O15118 6/20 0.75
RAB9A P51151 6/20 0.75
MEN1 O00255 4/20 0.75
KMT2A Q03164 4/20 0.75
ADORA3 P0DMS8 9/20 0.69
L3MBTL1 Q9Y468 1/20 0.59
RXFP1 Q9HBX9 1/20 0.56
HTT P42858 2/20 0.55
TP53 P04637 2/20 0.55
POLB P06746 1/20 0.55
NFKB1 P19838 1/20 0.55
NFKB2 Q00653 1/20 0.55
RELA Q04206 1/20 0.55
MAPT P10636 2/20 0.51
GFER P55789 1/20 0.51
ABL1 P00519 1/20 0.49

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
SCHEMBL9852174 0.87 ADORA3 (0.77) SMN1; SMN2LMNANPC1RAB9AMEN1
SCHEMBL3647705 0.77 SMN1; SMN2 (0.56) SMN1; SMN2LMNANPC1RAB9AMEN1
SCHEMBL12615025 0.75 PSMB8 (0.46) SMN1; SMN2LMNANPC1RAB9AMEN1
SCHEMBL20458189 0.74 ADORA3 (0.72) SMN1; SMN2LMNANPC1RAB9AMEN1
SCHEMBL16254958 0.74 SMN1; SMN2 (1.00) SMN1; SMN2LMNANPC1RAB9AMEN1
SCHEMBL29530821 0.74 ADORA3 (1.00) SMN1; SMN2LMNANPC1RAB9AMEN1
SCHEMBL9892965 0.73 SMN1; SMN2 (0.78) SMN1; SMN2LMNANPC1RAB9AMEN1
SCHEMBL1465115 0.72 SMN1; SMN2 (0.65) SMN1; SMN2LMNANPC1RAB9AMEN1
SCHEMBL13733960 0.72 RAB9A (0.63) SMN1; SMN2LMNANPC1RAB9AMEN1
SCHEMBL24866988 0.72 NPC1 (0.54) SMN1; SMN2LMNANPC1RAB9AMEN1

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
EP-0455356-A1 Substituted 5-amino-1,2,4-thiadiazoles with pharmaceutical activity LILLY INDUSTRIES LIMITED (GB) 1991-11-06 EP disclosed