SCHEMBL8539596

SCHEMBL8539596

CON1C(=O)C(=Cc2cc(C(C)(C)C)c(O)c(C(C)(C)C)c2)c2cc(OC3CC3)ccc21

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
EEF2K O00418 1/20 0.41
SRC P12931 1/20 0.41
CYP1A2 P05177 1/20 0.40
CYP2C9 P11712 1/20 0.40
EGFR P00533 2/20 0.39
SIRT1 Q96EB6 1/20 0.39
ERBB2 P04626 1/20 0.39
IGF1R P08069 1/20 0.39
CTRC Q99895 1/20 0.37
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 1/20 0.35
GAA P10253 1/20 0.35
KMT2A Q03164 1/20 0.35
PTGS2 P35354 4/20 0.35
PTGS1 P23219 3/20 0.35
ALOX5 P09917 1/20 0.35
PLK4 O00444 1/20 0.34

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
SCHEMBL9251015 0.88 EEF2K (0.46) EEF2KSRCCYP1A2CYP2C9EGFR
SCHEMBL8544169 0.82 EEF2K (0.47) EEF2KSRCCYP1A2CYP2C9EGFR
SCHEMBL8544871 0.82 EEF2K (0.40) EEF2KSRCCYP1A2CYP2C9EGFR
SCHEMBL8544637 0.81 EEF2K (0.46) EEF2KSRCCYP1A2CYP2C9EGFR
SCHEMBL8539973 0.80 EGFR (0.44) EEF2KSRCEGFRSIRT1ERBB2
SCHEMBL8544253 0.80 ERBB2 (0.54) EEF2KSRCCYP1A2CYP2C9EGFR
SCHEMBL8545505 0.80 EEF2K (0.44) EEF2KSRCCYP1A2CYP2C9EGFR
SCHEMBL8539727 0.78 EEF2K (0.49) EEF2KSRCCYP1A2CYP2C9EGFR
SCHEMBL8544618 0.77 EEF2K (0.48) EEF2KSRCCYP1A2CYP2C9EGFR
SCHEMBL7312445 0.76 PLK4 (0.52) EEF2KSRCCYP1A2CYP2C9EGFR

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-0580502-B1 3-(Hydroxybenzylidenyl)-indoline-2-ones and pharmaceutical compositions containing them ADIR (FR) 1998-09-02 EP disclosed
US-5382593-A Antioxidants or anticoagulants ADIR ET COMPAGNIE (FR) 1995-01-17 US disclosed
EP-0580502-A1 3-(Hydroxybenzylidenyl)-indoline-2-ones and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1994-01-26 EP disclosed