SCHEMBL8795346

SCHEMBL8795346

CCOc1nc(OCC)nc(N(C(=O)O)c2ccccc2)n1

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 2/20 0.45
GAA P10253 1/20 0.45
NPSR1 Q6W5P4 3/20 0.43
ALDH1A1 P00352 4/20 0.41
HTT P42858 3/20 0.41
LMNA P02545 2/20 0.41
MAPT P10636 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
KMT2A Q03164 2/20 0.41
NPC1 O15118 1/20 0.41
POLB P06746 1/20 0.41
RAB9A P51151 1/20 0.41
L3MBTL1 Q9Y468 2/20 0.40
ATM Q13315 1/20 0.40
MEN1 O00255 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
TSHR P16473 2/20 0.39
MAPK8 P45983 1/20 0.39
GLA P06280 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
SCHEMBL8795091 0.88 ALDH1A1 (0.44) HIF1AGAANPSR1ALDH1A1HTT
SCHEMBL9177288 0.86 HIF1A (0.41) HIF1AGAANPSR1ALDH1A1HTT
SCHEMBL8795075 0.84 EDNRB (0.46) GAANPSR1ALDH1A1HTTMAPT
SCHEMBL8795096 0.83 NPSR1 (0.47) NPSR1ALDH1A1HTTLMNAMAPT
SCHEMBL8626603 0.79 RXRA (0.41) GAANPSR1ALDH1A1HTTMAPT
SCHEMBL8795039 0.79 EDNRB (0.46) NPSR1MAPTKMT2ANPC1MEN1
SCHEMBL8634474 0.77 EDNRB (0.39) HIF1AGAANPSR1ALDH1A1HTT
SCHEMBL8630925 0.76 LMNA (0.43) HIF1AGAANPSR1ALDH1A1HTT
SCHEMBL8795221 0.75 EDNRB (0.42) NPSR1ALDH1A1HTTTDP1KMT2A
SCHEMBL8795165 0.75 NPSR1 (0.42) NPSR1ALDH1A1HTTLMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0645386-B1 N-Azinyl-N'-(het)arylsulfonylureas as herbicides BAYER AG (DE) 1997-12-29 EP disclosed
EP-0645386-A1 N-Azinyl-N'-(het)arylsulfonylureas as herbicides BAYER AG (DE) 1995-03-29 EP disclosed