SCHEMBL8549352

SCHEMBL8549352

ClCc1ccc(Oc2cccc(Oc3ccc(CCl)cc3)c2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.54
SMN1; SMN2 Q16637 3/20 0.54
MITF O75030 2/20 0.54
ST14 Q9Y5Y6 2/20 0.54
MEN1 O00255 1/20 0.54
GAA P10253 1/20 0.54
MAPT P10636 1/20 0.54
GFER P55789 1/20 0.54
KMT2A Q03164 1/20 0.54
NLRP1 Q9C000 1/20 0.54
NOD2 Q9HC29 1/20 0.54
TTR P02766 1/20 0.47
LTA4H P09960 1/20 0.47
FURIN P09958 2/20 0.46
F2 P00734 1/20 0.46
F10 P00742 1/20 0.46
HTT P42858 2/20 0.44
KDM4E B2RXH2 1/20 0.44
MAOB P27338 1/20 0.42
POLB P06746 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
SCHEMBL9502727 0.91 SMN1; SMN2 (0.61) ALDH1A1SMN1; SMN2TTRLTA4HHTT
SCHEMBL13857071 0.88 ALDH1A1 (0.46) ALDH1A1SMN1; SMN2MITFST14MEN1
SCHEMBL32670495 0.88 LPAR1 (0.45) ALDH1A1SMN1; SMN2MITFST14MEN1
SCHEMBL9502764 0.88 LPAR1 (0.45) ALDH1A1SMN1; SMN2MITFST14MEN1
SCHEMBL9502738 0.88 LTA4H (0.55) ALDH1A1SMN1; SMN2MITFST14MEN1
SCHEMBL9502686 0.87 ALDH1A1 (0.61) ALDH1A1SMN1; SMN2MITFMEN1GAA
SCHEMBL32670336 0.87 MAOB (0.50) ALDH1A1SMN1; SMN2MITFST14MEN1
SCHEMBL32670407 0.87 MMP14 (0.46) ALDH1A1SMN1; SMN2MITFST14MEN1
SCHEMBL32670377 0.87 ALDH1A1 (0.61) ALDH1A1SMN1; SMN2MITFMEN1GAA
SCHEMBL6159557 0.87 MMP14 (0.46) ALDH1A1SMN1; SMN2MITFST14MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0696585-B1 NOVEL BISOXADIAZOLIDINE DERIVATIVE YAMANOUCHI PHARMA CO LTD (JP) 1998-12-16 EP disclosed
US-5643931-A ANTIDIABETIC AGENTS YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1997-07-01 US disclosed
EP-0696585-A1 NOVEL BISOXADIAZOLIDINE DERIVATIVE YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1996-02-14 EP disclosed