SCHEMBL8551788

SCHEMBL8551788

O=Cc1ccc(Oc2cc(Oc3ccc(C=O)cc3)c(Cl)cc2Cl)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F2 P00734 1/20 0.50
F10 P00742 1/20 0.50
ALDH1A1 P00352 6/20 0.46
KDM4E B2RXH2 3/20 0.46
LMNA P02545 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
CYP2A6 P11509 1/20 0.45
TTR P02766 2/20 0.45
HSD17B10 Q99714 1/20 0.45
PARP10 Q53GL7 1/20 0.44
PARP3 Q9Y6F1 1/20 0.44
POLB P06746 1/20 0.43
CASP6 P55212 1/20 0.43
ALDH1A3 P47895 1/20 0.41
MPO P05164 1/20 0.41
TPO P07202 1/20 0.41
EPX P11678 1/20 0.41
LPO P22079 1/20 0.41
STS P08842 1/20 0.40
MAPT P10636 1/20 0.39

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
SCHEMBL8549986 0.85 ALDH1A1 (0.47) F2F10ALDH1A1KDM4ELMNA
SCHEMBL1508467 0.84 HSD17B10 (0.50) ALDH1A1KDM4ELMNASMN1; SMN2CYP2A6
SCHEMBL9265274 0.84 TTR (0.65) ALDH1A1KDM4ELMNASMN1; SMN2TTR
SCHEMBL6142404 0.81 TTR (0.47) ALDH1A1KDM4ELMNASMN1; SMN2TTR
SCHEMBL30378054 0.81 TTR (0.47) ALDH1A1KDM4ELMNASMN1; SMN2CYP2A6
SCHEMBL755560 0.81 TTR (0.47) ALDH1A1KDM4ELMNASMN1; SMN2CYP2A6
SCHEMBL29984 0.81 ALDH1A1 (0.43) F2F10ALDH1A1KDM4ELMNA
SCHEMBL24512660 0.80 TTR (0.60) ALDH1A1KDM4ESMN1; SMN2TTRHSD17B10
SCHEMBL30758635 0.79 ALDH1A1 (0.49) ALDH1A1KDM4ELMNASMN1; SMN2CYP2A6
SCHEMBL2317083 0.79 ALDH1A1 (0.49) ALDH1A1KDM4ELMNASMN1; SMN2CYP2A6

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