SCHEMBL2426458

SCHEMBL2426458

Cc1ccc(O)c2c(=O)cc(C34C5C6C7C3[Fe]6754389%10C4C3C8C9C4%10)oc12

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 3/20 0.35
▸ MAPT P10636 3/20 0.35
▸ KDM4E B2RXH2 3/20 0.35
▸ LMNA P02545 2/20 0.35
▸ GAA P10253 2/20 0.35
▸ ALOX15 P16050 2/20 0.35
▸ CYP3A4 P08684 2/20 0.35
▸ CYP1A2 P05177 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ RECQL P46063 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ MAOA P21397 4/20 0.33
▸ ESR2 Q92731 5/20 0.33
▸ ESR1 P03372 4/20 0.33
▸ ATM Q13315 1/20 0.33
▸ MAOB P27338 3/20 0.32
▸ CSNK2A2 P19784 2/20 0.32
▸ CSNK2B P67870 2/20 0.32

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
SCHEMBL2426911 0.77 AR (0.47) MAPTKDM4EALOX15CYP3A4CYP1A2
SCHEMBL2423719 0.77 TERT (0.48) TP53MAPTKDM4ELMNAGAA
SCHEMBL2426361 0.74 ALOX15 (0.38) TP53MAPTKDM4EGAAALOX15
SCHEMBL2423287 0.72 KMT2A (0.38) TP53MAPTKDM4ECYP3A4POLB
SCHEMBL2427225 0.72 KMT2A (0.54) TP53MAPTKDM4ELMNAGAA
SCHEMBL2424752 0.70 PTGS1 (0.56) TP53MAPTKDM4ELMNAGAA
SCHEMBL2421160 0.68 KDM4E (0.48) TP53MAPTKDM4ELMNAGAA
SCHEMBL2427139 0.68 HPGD (0.49) TP53MAPTKDM4ELMNAALOX15
SCHEMBL2425388 0.68 MAPT (0.48) TP53MAPTKDM4ECYP3A4POLB
SCHEMBL2430119 0.68 ALDH1A1 (0.49) TP53MAPTKDM4EGAACYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2368895-A1 Ferrocenyl flavonoids Centre National de la Recherche Scientifique (CNRS) (FR) 2011-09-28 — — EP disclosed
WO-2011107572-A1 FERROCENYL FLAVONOIDS CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 2011-09-09 — — WO disclosed
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