SCHEMBL8627862

SCHEMBL8627862

COc1cc(Cl)nc(-c2ccccc2NC(=O)O)n1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.46
KDM4E B2RXH2 4/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
KMT2A Q03164 5/20 0.44
LMNA P02545 2/20 0.44
MAPT P10636 5/20 0.44
NPC1 O15118 1/20 0.44
FGFR4 P22455 1/20 0.41
TAS1R3 Q7RTX0 1/20 0.40
TAS1R1 Q7RTX1 1/20 0.40
TAS1R2 Q8TE23 1/20 0.40
ABCG2 Q9UNQ0 1/20 0.40
IGF1R P08069 1/20 0.40
HTT P42858 2/20 0.40
MAPK3 P27361 1/20 0.39
MEN1 O00255 2/20 0.39
S1PR2 O95136 1/20 0.39

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
SCHEMBL5193130 0.92 MAPT (0.48) ALDH1A1KDM4ESMN1; SMN2L3MBTL1KMT2A
SCHEMBL8540029 0.88 MAPT (0.48) ALDH1A1KDM4ESMN1; SMN2L3MBTL1KMT2A
SCHEMBL8626602 0.86 ALDH1A1 (0.49) ALDH1A1KDM4ESMN1; SMN2L3MBTL1KMT2A
SCHEMBL8629851 0.85 KMT2A (0.60) ALDH1A1KDM4ESMN1; SMN2L3MBTL1KMT2A
SCHEMBL8873905 0.85 MAPT (0.41) ALDH1A1KDM4ESMN1; SMN2L3MBTL1KMT2A
SCHEMBL8628972 0.84 ALDH1A1 (0.44) ALDH1A1KDM4EL3MBTL1KMT2ALMNA
SCHEMBL8626593 0.84 MAPT (0.39) ALDH1A1KDM4ESMN1; SMN2L3MBTL1KMT2A
SCHEMBL8631357 0.82 KMT2A (0.43) ALDH1A1KDM4ESMN1; SMN2L3MBTL1KMT2A
SCHEMBL8627986 0.81 MRGPRX1 (0.40) ALDH1A1KDM4ESMN1; SMN2L3MBTL1KMT2A
SCHEMBL8632963 0.81 KMT2A (0.42) ALDH1A1KDM4EL3MBTL1KMT2ALMNA

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