SCHEMBL8561075

SCHEMBL8561075

CSc1nc(Br)cc(OCc2ccccc2)n1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 3/20 0.48
▸ PTGES O14684 1/20 0.48
▸ NUDT1 P36639 1/20 0.45
▸ ADORA3 P0DMS8 1/20 0.44
▸ ADORA1 P30542 1/20 0.44
▸ PPARG P37231 2/20 0.43
▸ KMT2A Q03164 2/20 0.42
▸ HTT P42858 2/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ ALDH1A1 P00352 2/20 0.40
▸ HRH4 Q9H3N8 1/20 0.40
▸ MAOB P27338 1/20 0.40
▸ GABRG2 P18507 1/20 0.39
▸ GABRB3 P28472 1/20 0.39
▸ GABRA5 P31644 1/20 0.39
▸ GABRA3 P34903 1/20 0.39
▸ HSP90AA1 P07900 1/20 0.39
▸ THRB P10828 1/20 0.39
▸ MAPK14 Q16539 1/20 0.38
▸ GAA P10253 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
SCHEMBL8557424 0.84 KMT2A (0.61) ALOX5PTGESNUDT1ADORA3ADORA1
SCHEMBL8562004 0.84 ALOX5 (0.46) ALOX5PTGESNUDT1ADORA3ADORA1
SCHEMBL8558770 0.82 ALOX5 (0.48) ALOX5PTGESNUDT1ADORA3ADORA1
SCHEMBL8561459 0.79 PTGES (0.43) ALOX5PTGESNUDT1ADORA3ADORA1
SCHEMBL7706826 0.78 ALDH1A1 (0.47) ALOX5PTGESNUDT1HTTALDH1A1
SCHEMBL8773216 0.78 MAOB (0.51) ALOX5PTGESNUDT1HTTALDH1A1
SCHEMBL3545118 0.77 ALKBH1 (0.43) ALOX5PTGESNUDT1ADORA3ADORA1
SCHEMBL8562901 0.74 SMN1; SMN2 (0.45) ALOX5PTGESNUDT1ADORA3ADORA1
SCHEMBL17594829 0.74 MAOB (0.58) ALOX5KMT2AMEN1MAOBGAA
SCHEMBL3875774 0.72 LMNA (0.46) ALDH1A1MAPK14GAALMNAL3MBTL1

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
US-5726128-A Benzyloxypyrimidine derivative, processes for producing the same and herbicidal composition KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1998-03-10 — — US disclosed
EP-0707001-A1 Benzyloxypyrimidine derivative, processes for producing the same and herbicidal composition KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1996-04-17 — — EP disclosed
Send feedback