SCHEMBL8889284

SCHEMBL8889284

O=C1C=C(OC(=O)c2ccc(Cl)cc2S(=O)(=O)N2CCCC2)CCC1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.51
POLB P06746 3/20 0.51
KDM4E B2RXH2 2/20 0.51
HPGD P15428 1/20 0.51
RAB9A P51151 1/20 0.51
TSHR P16473 4/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
ALOX15 P16050 1/20 0.50
HTT P42858 1/20 0.44
MAPT P10636 2/20 0.44
KMT2A Q03164 4/20 0.43
LMNA P02545 2/20 0.41
MEN1 O00255 2/20 0.41
TDP1 Q9NUW8 1/20 0.41

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
SCHEMBL8671189 0.78 RAB9A (0.41) ALDH1A1RAB9ATSHRL3MBTL1MAPT
SCHEMBL8888158 0.78 L3MBTL1 (0.51) ALDH1A1POLBL3MBTL1TDP1
SCHEMBL8671317 0.76 ALDH1A1 (0.67) ALDH1A1POLBKDM4EHPGDRAB9A
SCHEMBL9820457 0.73 MAPT (0.42) ALDH1A1RAB9AMAPTKMT2ALMNA
SCHEMBL8889487 0.72 ALDH1A1 (0.53) ALDH1A1POLBKDM4EHPGDRAB9A
SCHEMBL15133253 0.72 MAPT (0.36) POLBHPGDRAB9AALOX15MAPT
SCHEMBL197131 0.70 ALDH1A1 (1.00) ALDH1A1POLBKDM4EHPGDRAB9A
SCHEMBL30230026 0.69 L3MBTL1 (0.35) ALDH1A1HPGDL3MBTL1MAPTKMT2A
SCHEMBL5321593 0.69 ALDH1A1 (0.73) ALDH1A1POLBKDM4EHPGDRAB9A
SCHEMBL6422908 0.68 TSHR (1.00) ALDH1A1POLBKDM4EHPGDRAB9A

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-1997003045-A1 HERBICIDAL SULFONAMIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1997-01-30 WO disclosed