SCHEMBL8551187

SCHEMBL8551187

ClCc1ccc(Oc2ccc(Oc3ccc(CCl)cc3)cc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ST14 Q9Y5Y6 1/20 0.48
LTA4H P09960 2/20 0.46
TTR P02766 2/20 0.42
TSHR P16473 2/20 0.41
ALDH1A1 P00352 1/20 0.41
CYP3A4 P08684 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
ESR1 P03372 1/20 0.41
ESR2 Q92731 1/20 0.41
CA1 P00915 2/20 0.41
CA2 P00918 2/20 0.41
FFAR1 O14842 1/20 0.39
MAOA P21397 1/20 0.39
MAOB P27338 1/20 0.39
SRD5A2 P31213 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
SCHEMBL1338731 1.00 ST14 (0.48) ST14LTA4HTTRTSHRALDH1A1
SCHEMBL510124 0.90 LTA4H (0.61) LTA4HTTRTSHRCA1CA2
SCHEMBL2987196 0.90 MAOB (0.54) ST14LTA4HTTRMAOAMAOB
SCHEMBL9505702 0.88 SMN1; SMN2 (0.49) ST14LTA4HTTRTSHRALDH1A1
SCHEMBL6158659 0.88 MAPT (0.52) ST14LTA4HMEN1KMT2ACA2
SCHEMBL2072044 0.88 LTA4H (0.46) ST14LTA4HMAOAMAOB
SCHEMBL6161837 0.88 TEAD4 (0.52) ST14LTA4HTTRALDH1A1TDP1
SCHEMBL6157954 0.88 LTA4H (0.54) LTA4HTTRTSHRALDH1A1CYP3A4
SCHEMBL8549352 0.86 ALDH1A1 (0.54) ST14LTA4HTTRALDH1A1TDP1
SCHEMBL6158908 0.84 LTA4H (0.61) LTA4HTSHRALDH1A1TDP1MEN1

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