SCHEMBL8551768

SCHEMBL8551768

O=Cc1ccc(Oc2cccc(Oc3ccc(C=O)cc3)n2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.58
MAPT P10636 1/20 0.58
KDM4E B2RXH2 4/20 0.56
SMN1; SMN2 Q16637 2/20 0.56
LMNA P02545 1/20 0.56
F2 P00734 2/20 0.49
F10 P00742 2/20 0.49
L3MBTL1 Q9Y468 2/20 0.49
PRSS1 P07477 1/20 0.49
PRSS2 P07478 1/20 0.49
PRSS3 P35030 1/20 0.49
ST14 Q9Y5Y6 1/20 0.49
CYP2A6 P11509 2/20 0.47
PARP10 Q53GL7 1/20 0.46
PARP3 Q9Y6F1 1/20 0.46
POLB P06746 2/20 0.44
CASP6 P55212 1/20 0.44
ALDH1A3 P47895 1/20 0.42
KMT2A Q03164 1/20 0.42
STS P08842 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
SCHEMBL30306040 0.88 KDM4E (0.50) ALDH1A1MAPTKDM4ESMN1; SMN2LMNA
SCHEMBL9107425 0.88 KDM4E (0.50) ALDH1A1MAPTKDM4ESMN1; SMN2LMNA
SCHEMBL9106409 0.84 ALDH1A1 (0.46) ALDH1A1MAPTKDM4ESMN1; SMN2LMNA
SCHEMBL510396 0.79 ALDH1A1 (0.66) ALDH1A1MAPTKDM4ESMN1; SMN2LMNA
SCHEMBL31238491 0.79 ALDH1A1 (0.66) ALDH1A1MAPTKDM4ESMN1; SMN2LMNA
SCHEMBL97639 0.79 ALDH1A1 (0.59) ALDH1A1MAPTKDM4ESMN1; SMN2LMNA
SCHEMBL888020 0.79 ALDH1A1 (0.59) ALDH1A1MAPTKDM4ESMN1; SMN2LMNA
SCHEMBL5050902 0.78 PARP10 (0.65) ALDH1A1MAPTKDM4ESMN1; SMN2LMNA
SCHEMBL1663469 0.78 PARP10 (0.65) ALDH1A1MAPTKDM4ESMN1; SMN2LMNA
SCHEMBL9540409 0.77 LMNA (0.43) ALDH1A1MAPTSMN1; SMN2LMNAF2

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