SCHEMBL8305561

SCHEMBL8305561

Cc1[c]c(Oc2cccc(Oc3c(F)cccc3F)c2)ccc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GCK P35557 4/20 0.37
MAPT P10636 3/20 0.37
POLB P06746 1/20 0.37
HSP90AA1 P07900 1/20 0.37
ALDH1A1 P00352 3/20 0.34
SMN1; SMN2 Q16637 3/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
LMNA P02545 1/20 0.33
HTT P42858 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
AR P10275 1/20 0.33
HTR1A P08908 1/20 0.33
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33
SLC6A3 Q01959 1/20 0.33
HIF1A Q16665 1/20 0.32
PPARG P37231 1/20 0.32
KDM4E B2RXH2 1/20 0.31
MITF O75030 1/20 0.31

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
SCHEMBL7306006 0.77 LTA4H (0.44) MAPTSMN1; SMN2KMT2ALMNAHTT
SCHEMBL19602284 0.75 ACHE (0.52) GCKMAPTPOLBHSP90AA1ALDH1A1
SCHEMBL19602281 0.68 MAPT (0.72) GCKMAPTPOLBHSP90AA1ALDH1A1
SCHEMBL19602282 0.68 POLB (0.43) GCKMAPTPOLBHSP90AA1SMN1; SMN2
SCHEMBL778774 0.68 MAOB (0.44) MAPTPOLBHSP90AA1ALDH1A1SMN1; SMN2
SCHEMBL328383 0.68 ACHE (0.52) MAPTPOLBALDH1A1SMN1; SMN2MEN1
SCHEMBL21486338 0.67 TEAD4 (0.45) GCKMAPTPOLBALDH1A1SMN1; SMN2
SCHEMBL29062557 0.67 SMN1; SMN2 (0.50) MAPTPOLBALDH1A1SMN1; SMN2MEN1
SCHEMBL28400248 0.66 NFE2L2 (0.39) MAPTPOLBHSP90AA1ALDH1A1HTR1A
SCHEMBL257605 0.66 ACHE (0.47) MAPTPOLBHSP90AA1ALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0937051-A1 FUNGICIDAL CYCLIC AMIDES E.I. DU PONT DE NEMOURS & COMPANY INCORPORATED (US) 1999-08-25 EP claimed
WO-1998020003-A1 FUNGICIDAL CYCLIC AMIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1998-05-14 WO claimed
EP-0937051-A1 FUNGICIDAL CYCLIC AMIDES E.I. DU PONT DE NEMOURS & COMPANY INCORPORATED (US) 1999-08-25 EP disclosed
WO-1998020003-A1 FUNGICIDAL CYCLIC AMIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1998-05-14 WO disclosed