SCHEMBL1576783

SCHEMBL1576783

CCOc1cc(Cl)nc(N)n1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.55
ALDH1A1 P00352 2/20 0.54
RAB9A P51151 2/20 0.54
NPC1 O15118 1/20 0.54
MAPK1 P28482 1/20 0.54
KMT2A Q03164 3/20 0.50
MEN1 O00255 1/20 0.50
KDM4E B2RXH2 3/20 0.49
HPGD P15428 1/20 0.45
NUDT1 P36639 3/20 0.42
POLB P06746 1/20 0.41
HSP90AB1 P08238 5/20 0.40
HSP90AA1 P07900 4/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C19 P33261 1/20 0.39
LMNA P02545 1/20 0.38

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
SCHEMBL1576650 0.86 NPC1 (0.62) SMN1; SMN2ALDH1A1RAB9ANPC1MAPK1
SCHEMBL5915041 0.85 ALDH1A1 (0.54) SMN1; SMN2ALDH1A1RAB9ANPC1MAPK1
SCHEMBL1146187 0.82 ALDH1A1 (0.44) SMN1; SMN2ALDH1A1RAB9ANPC1MAPK1
SCHEMBL17581322 0.80 SMN1; SMN2 (0.48) SMN1; SMN2ALDH1A1RAB9ANPC1MAPK1
SCHEMBL2800474 0.80 NPC1 (0.57) SMN1; SMN2ALDH1A1RAB9ANPC1MAPK1
SCHEMBL9432871 0.80 KDM4E (0.39) SMN1; SMN2ALDH1A1RAB9ANPC1MAPK1
SCHEMBL24755030 0.79 SMN1; SMN2 (0.69) SMN1; SMN2ALDH1A1RAB9ANPC1MAPK1
SCHEMBL8388439 0.78 POLB (0.41) SMN1; SMN2ALDH1A1RAB9ANPC1MAPK1
SCHEMBL21494963 0.78 ALDH1A1 (0.38) SMN1; SMN2ALDH1A1RAB9ANPC1MAPK1
SCHEMBL8630748 0.78 NPC1 (0.56) SMN1; SMN2ALDH1A1RAB9ANPC1MAPK1

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011039276-A1 OXATHIAZINYL(HET)ARYLSULFONYLUREAS, PROCESSES AND INTERMEDIATES FOR PREPARATION THEREOF AND USE THEREOF AS CROP PROTECTION AGENTS AND CROP GROWTH REGULATORS BAYER CROPSCIENCE AG (DE) 2011-04-07 WO disclosed
US-20060035913-A1 Method for the production of 2-amino-4-chloro-6-alkoxypyrimidines DEGUSSA AG (DE) 2006-02-16 US disclosed
EP-1554255-A1 METHOD FOR THE PRODUCTION OF 2-AMINO-4-CHLORO-6-ALKOXYPYRIMIDINES Degussa AG (DE) 2005-07-20 EP disclosed
WO-2004037795-A1 METHOD FOR THE PRODUCTION OF 2-AMINO-4-CHLORO-6-ALKOXYPYRIMIDINES DEGUSSA AG (DE) 2004-05-06 WO disclosed
EP-0645386-B1 N-Azinyl-N'-(het)arylsulfonylureas as herbicides BAYER AG (DE) 1997-12-29 EP disclosed
US-5580842-A HERBICIDES BAYER AKTIENGESELLSCHAFT (DE) 1996-12-03 US disclosed
US-5476936-A Herbicides BAYER AKTIENGESELLSCHAFT (DE) 1995-12-19 US disclosed
EP-0645386-A1 N-Azinyl-N'-(het)arylsulfonylureas as herbicides BAYER AG (DE) 1995-03-29 EP disclosed
US-4655821-A HERBICIDES E. I. DU PONT DE NEMOURS AND COMPANY (US) 1987-04-07 US disclosed
US-4543120-A HERBICIDES, PLATN GROWTH REGULANTS E. I. DU PONT DE NEMOURS AND COMPANY (US) 1985-09-24 US disclosed
EP-0101308-A2 Alkyl sulfonyl sulfonamides E.I. DU PONT DE NEMOURS AND COMPANY (US) 1984-02-22 EP disclosed