SCHEMBL7969618

SCHEMBL7969618

O=S(=O)(c1ccc(Br)cc1)c1cccc(Cl)n1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 3/20 0.50
▸ LMNA P02545 1/20 0.50
▸ MAPT P10636 1/20 0.50
▸ AKR1B1 P15121 1/20 0.45
▸ KDM4E B2RXH2 2/20 0.44
▸ PKM P14618 1/20 0.44
▸ ALDH1A1 P00352 3/20 0.40
▸ SMN1; SMN2 Q16637 2/20 0.40
▸ CYP3A4 P08684 2/20 0.40
▸ MEN1 O00255 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ TSHR P16473 1/20 0.40
▸ RXFP1 Q9HBX9 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ PTGS1 P23219 1/20 0.40
▸ PTGS2 P35354 1/20 0.40
▸ NFE2L2 Q16236 2/20 0.39
▸ CA2 P00918 1/20 0.38
▸ PIK3CA P42336 2/20 0.38
▸ PLCG1 P19174 1/20 0.37

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
SCHEMBL1573955 0.84 TSHR (0.48) HTTMAPTAKR1B1KDM4EPKM
SCHEMBL1620183 0.83 NFE2L2 (0.54) HTTLMNAMAPTAKR1B1KDM4E
SCHEMBL7971332 0.83 GAA (0.50) HTTLMNAMAPTAKR1B1KDM4E
SCHEMBL7958580 0.79 KMT2A (0.44) KDM4EPKMALDH1A1MEN1KMT2A
SCHEMBL1619865 0.79 NFE2L2 (0.57) HTTLMNAMAPTAKR1B1KDM4E
SCHEMBL7974892 0.72 KMT2A (0.64) HTTLMNAMAPTALDH1A1SMN1; SMN2
SCHEMBL9174593 0.72 NFE2L2 (0.44) HTTMAPTKDM4EPKMALDH1A1
Lithium Ion SCHEMBL9176164 0.72 NFE2L2 (0.44) HTTMAPTKDM4EPKMALDH1A1
Potassium Ion SCHEMBL9175274 0.72 NFE2L2 (0.44) HTTMAPTKDM4EPKMALDH1A1
SCHEMBL4016427 0.71 PKM (0.69) HTTLMNAMAPTAKR1B1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2001017965-A2 CYANOPIPERIDINES AS PESTICIDES SYNGENTA PARTICIPATIONS AG (CH) 2001-03-15 — — WO disclosed
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