SCHEMBL8433918

SCHEMBL8433918

O=C(O)c1c(C(=O)O)c(O)c2c(C(=O)O)cccc2c1C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR4A1 P22736 1/20 0.46
NR4A2 P43354 1/20 0.46
NR4A3 Q92570 1/20 0.46
CDC25B P30305 1/20 0.44
KDM4E B2RXH2 4/20 0.44
HSD17B10 Q99714 3/20 0.44
HPGD P15428 3/20 0.44
ALDH1A1 P00352 3/20 0.44
ALB P02768 1/20 0.44
MMP2 P08253 1/20 0.44
PARP1 P09874 1/20 0.42
CYP2C9 P11712 2/20 0.42
CYP3A4 P08684 1/20 0.42
KMT2A Q03164 1/20 0.42
CA12 O43570 2/20 0.42
CA1 P00915 2/20 0.42
CA2 P00918 2/20 0.42
CA7 P43166 2/20 0.42
CA9 Q16790 2/20 0.42
CA14 Q9ULX7 2/20 0.42

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
SCHEMBL471836 0.86 NR4A1 (0.50) NR4A1NR4A2NR4A3CDC25BKDM4E
SCHEMBL31401751 0.86 NR4A1 (0.50) NR4A1NR4A2NR4A3CDC25BKDM4E
SCHEMBL820873 0.82 NR4A1 (0.54) NR4A1NR4A2NR4A3CDC25BKDM4E
SCHEMBL29549589 0.78 NR4A1 (0.54) NR4A1NR4A2NR4A3CDC25BKDM4E
SCHEMBL126721 0.78 NR4A1 (0.54) NR4A1NR4A2NR4A3CDC25BKDM4E
SCHEMBL9170208 0.77 CA12 (0.52) NR4A1NR4A2NR4A3CDC25BKDM4E
SCHEMBL20349104 0.77 NR4A1 (0.53) NR4A1NR4A2NR4A3CDC25BKDM4E
SCHEMBL9505995 0.76 CYP1A2 (0.61) NR4A1NR4A2NR4A3CDC25BKDM4E
SCHEMBL3936588 0.76 NR4A1 (0.47) NR4A1NR4A2NR4A3CDC25BKDM4E
SCHEMBL31401818 0.76 NR4A1 (0.47) NR4A1NR4A2NR4A3CDC25BKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-7149895-A None JP disclosed
EP-0699963-B1 Magnetic toner and image forming method CANON KK (JP) 1999-12-01 EP disclosed
US-5641600-A TONER COMPRISING BINDER RESIN AND MAGNETIC FINE PARTICLES COATED WITH IRON-ZINC OXIDE ON SURFACES AND HAVING SPECIFIED PROPERTIES CANON KABUSHIKI KAISHA (JP) 1997-06-24 US disclosed
EP-0699963-A1 Magnetic toner and image forming method CANON KABUSHIKI KAISHA (JP) 1996-03-06 EP disclosed
JP-H07149895-A POLYIMIDE PRECURSOR COMPOSITION, POLYIMIDE COMPOSITION AND THEIR PRODUCTION CENTRAL GLASS CO LTD 1995-06-13 JP disclosed