SCHEMBL2424542

SCHEMBL2424542

CC(=O)Nc1ccc2oc(C34C5C6C7C3[Fe]6754389%10C4C3C8C9C4%10)cc(=O)c2c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CSNK2A2 P19784 2/20 0.47
▸ CSNK2B P67870 2/20 0.47
▸ CSNK2A1 P68400 1/20 0.47
▸ POLB P06746 3/20 0.44
▸ KMT2A Q03164 2/20 0.44
▸ MAPT P10636 2/20 0.44
▸ MEN1 O00255 1/20 0.44
▸ KDM4E B2RXH2 3/20 0.41
▸ ALDH1A1 P00352 3/20 0.41
▸ CA12 O43570 2/20 0.41
▸ CA9 Q16790 2/20 0.41
▸ HPGD P15428 2/20 0.41
▸ ESR1 P03372 1/20 0.41
▸ CA1 P00915 1/20 0.41
▸ MAP2K1 Q02750 1/20 0.39
▸ MAOB P27338 3/20 0.38
▸ MAOA P21397 1/20 0.38
▸ PKM P14618 1/20 0.38
▸ ALOX15 P16050 1/20 0.38
▸ TSHR P16473 1/20 0.38

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
SCHEMBL2420589 0.91 CA12 (0.50) CSNK2A2CSNK2BCSNK2A1POLBKMT2A
SCHEMBL2427311 0.86 ALDH1A1 (0.49) POLBKMT2AMAPTMEN1KDM4E
SCHEMBL2425388 0.78 MAPT (0.48) CSNK2A2CSNK2BCSNK2A1POLBMAPT
SCHEMBL2424881 0.78 MAPT (0.49) CSNK2A2CSNK2BCSNK2A1KMT2AMAPT
SCHEMBL2426267 0.78 STS (0.58) CSNK2A2CSNK2BCSNK2A1KMT2AMEN1
SCHEMBL2424973 0.76 ADCY1 (0.49) CSNK2A2CSNK2BCSNK2A1MAPTKDM4E
SCHEMBL17786550 0.75 CSNK2A2 (0.55) CSNK2A2CSNK2BCSNK2A1POLBKMT2A
SCHEMBL2427801 0.75 ALDH1A1 (0.52) CSNK2A2CSNK2BCSNK2A1POLBKMT2A
SCHEMBL2425083 0.74 TNKS (0.45) CSNK2A2CSNK2BCSNK2A1POLBMAPT
SCHEMBL5560749 0.73 KMT2A (0.60) CSNK2A2CSNK2BCSNK2A1POLBKMT2A

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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