SCHEMBL8628193

SCHEMBL8628193

c1ccc(CSc2ccccc2C2=NCCOO2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.41
HTT P42858 1/20 0.38
EGFR P00533 4/20 0.35
HSD17B10 Q99714 1/20 0.35
PTPRC P08575 1/20 0.35
ALDH1A1 P00352 4/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
RAB9A P51151 2/20 0.35
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA9 Q16790 1/20 0.35
CA14 Q9ULX7 1/20 0.35
NPC1 O15118 1/20 0.35
HPGD P15428 1/20 0.35
MAPK1 P28482 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
KDM4E B2RXH2 1/20 0.35
NPSR1 Q6W5P4 1/20 0.34
MEN1 O00255 2/20 0.34

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
SCHEMBL8631968 0.73 POLB (0.42) POLBHTTEGFRHSD17B10ALDH1A1
SCHEMBL4355515 0.69 POLB (0.44) POLBHTTEGFRHSD17B10ALDH1A1
SCHEMBL4071617 0.69 NISCH (0.61) POLBALDH1A1KDM4E
SCHEMBL6777717 0.68 POLB (0.59) POLBEGFRHSD17B10PTPRCSMN1; SMN2
SCHEMBL4070724 0.67 NISCH (0.51) POLBHSD17B10MEN1KMT2AL3MBTL1
Bromide SCHEMBL4909528 0.66 NISCH (0.50) POLBHSD17B10MEN1KMT2AL3MBTL1
SCHEMBL895641 0.64 SMN1; SMN2 (0.43) ALDH1A1SMN1; SMN2RAB9AHPGDKDM4E
SCHEMBL430583 0.64 POLB (0.63) POLBHTTHSD17B10PTPRCALDH1A1
SCHEMBL731647 0.64 RAB9A (0.59) POLBHTTHSD17B10ALDH1A1SMN1; SMN2
SCHEMBL10763514 0.64 POLB (0.45) POLBHTTEGFRHSD17B10ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5847126-A N-azinyl-N'-(het) arylsulphonyl-ureas BAYER AKTIENGESELLSCHAFT (DE) 1998-12-08 US disclosed
EP-0645386-B1 N-Azinyl-N'-(het)arylsulfonylureas as herbicides BAYER AG (DE) 1997-12-29 EP disclosed
US-5696257-A INTERMEDIATES FOR HERBICIDES BAYER AKTIENGESELLSCHAFT (DE) 1997-12-09 US 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