SCHEMBL1576921

SCHEMBL1576921

CCOc1cc(N(C)C)nc(N)n1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 2/20 0.51
▸ RAB9A P51151 2/20 0.51
▸ ALDH1A1 P00352 1/20 0.51
▸ MAPK1 P28482 1/20 0.51
▸ NUDT1 P36639 4/20 0.47
▸ POLB P06746 1/20 0.39
▸ KDM4E B2RXH2 2/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ SMN1; SMN2 Q16637 3/20 0.36
▸ LMNA P02545 1/20 0.36
▸ PDPK1 O15530 1/20 0.35
▸ TGFBR1 P36897 1/20 0.35
▸ HRH4 Q9H3N8 1/20 0.35
▸ HRH3 Q9Y5N1 1/20 0.34
▸ HPGD P15428 1/20 0.33

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 0.82 NPC1 (0.62) NPC1RAB9AALDH1A1MAPK1NUDT1
SCHEMBL1576997 0.79 NUDT1 (0.52) NPC1RAB9AALDH1A1NUDT1POLB
SCHEMBL2800474 0.77 NPC1 (0.57) NPC1RAB9AALDH1A1MAPK1NUDT1
SCHEMBL1576638 0.76 NUDT1 (0.65) NUDT1KDM4EKMT2ASMN1; SMN2PDPK1
SCHEMBL18134205 0.76 NUDT1 (0.66) NPC1RAB9AALDH1A1MAPK1NUDT1
SCHEMBL8630748 0.76 NPC1 (0.56) NPC1RAB9AALDH1A1MAPK1NUDT1
SCHEMBL8446516 0.74 NPC1 (0.54) NPC1RAB9AALDH1A1MAPK1NUDT1
SCHEMBL1576783 0.74 SMN1; SMN2 (0.55) NPC1RAB9AALDH1A1MAPK1NUDT1
SCHEMBL8873952 0.74 NUDT1 (0.46) NUDT1KDM4EKMT2APDPK1TGFBR1
SCHEMBL6395516 0.73 FGFR1 (0.37) NUDT1POLBPDPK1

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 5 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
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
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