SCHEMBL8631968

SCHEMBL8631968

c1ccc(CSc2ccccc2C2=NOCCO2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.42
HTT P42858 1/20 0.39
TERT O14746 1/20 0.36
METAP2 P50579 1/20 0.36
HSD17B10 Q99714 1/20 0.36
EGFR P00533 5/20 0.35
RAB9A P51151 4/20 0.35
SMN1; SMN2 Q16637 3/20 0.35
NPC1 O15118 2/20 0.35
HPGD P15428 1/20 0.35
MAPK1 P28482 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
KMT2A Q03164 3/20 0.35
MEN1 O00255 2/20 0.35
L3MBTL1 Q9Y468 3/20 0.34
S100A4 P26447 1/20 0.34
MAPT P10636 2/20 0.34
SAE1 Q9UBE0 1/20 0.34
UBA2 Q9UBT2 1/20 0.34
ALDH1A1 P00352 2/20 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
SCHEMBL3783930 0.85 CA12 (0.42) POLBHTTTERTMETAP2HSD17B10
SCHEMBL8633533 0.82 ALDH1A1 (0.33) TERTMETAP2RAB9ASMN1; SMN2NPC1
SCHEMBL2990110 0.81 ALDH1A1 (0.46) HTTTERTHSD17B10RAB9ASMN1; SMN2
SCHEMBL8629611 0.80 NPC1 (0.42) POLBHTTTERTMETAP2HSD17B10
SCHEMBL27455985 0.80 POLB (0.41) POLBHTTTERTMETAP2EGFR
SCHEMBL8633923 0.79 PTPRC (0.44) POLBHTTTERTMETAP2HSD17B10
SCHEMBL4355515 0.78 POLB (0.44) POLBHTTHSD17B10EGFRRAB9A
SCHEMBL3259116 0.78 SMN1; SMN2 (0.35) TERTMETAP2HSD17B10RAB9ASMN1; SMN2
SCHEMBL8629590 0.77 MAPT (0.41) HTTTERTMETAP2RAB9ASMN1; SMN2
SCHEMBL8628193 0.73 POLB (0.41) POLBHTTHSD17B10EGFRRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5696257-A INTERMEDIATES FOR HERBICIDES BAYER AKTIENGESELLSCHAFT (DE) 1997-12-09 US claimed
JP-7118269-A None JP disclosed
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
CN-1108656-A N-azinyl-N'-(HET)arylsulphonyl-ureas BAYER AG (DE) 1995-09-20 CN disclosed
JP-H07118269-A N-AZINYL-N'-(HET)ARYLSULFONYLUREA BAYER AG 1995-05-09 JP disclosed
EP-0645386-A1 N-Azinyl-N'-(het)arylsulfonylureas as herbicides BAYER AG (DE) 1995-03-29 EP disclosed