SCHEMBL17786371

SCHEMBL17786371

COc1cccc(-c2cc(=O)c3cc(NC(C)=O)ccc3o2)c1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CSNK2A2 P19784 3/20 0.69
▸ CSNK2B P67870 3/20 0.69
▸ CSNK2A1 P68400 3/20 0.69
▸ KDM4E B2RXH2 6/20 0.68
▸ CYP3A4 P08684 5/20 0.68
▸ MAPT P10636 5/20 0.68
▸ KMT2A Q03164 4/20 0.68
▸ MAPK1 P28482 3/20 0.68
▸ TP53 P04637 3/20 0.68
▸ MEN1 O00255 3/20 0.68
▸ CYP2C9 P11712 3/20 0.68
▸ TSHR P16473 3/20 0.68
▸ CYP2C19 P33261 3/20 0.68
▸ ALDH1A1 P00352 5/20 0.61
▸ SMN1; SMN2 Q16637 5/20 0.61
▸ HPGD P15428 4/20 0.61
▸ HSD17B10 Q99714 3/20 0.61
▸ RECQL P46063 2/20 0.61
▸ USP2 O75604 1/20 0.61
▸ ABCB1 P08183 1/20 0.58

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
SCHEMBL17786469 0.89 CSNK2A2 (0.60) CSNK2A2CSNK2BCSNK2A1KDM4ECYP3A4
SCHEMBL926774 0.87 CSNK2A2 (0.72) CSNK2A2CSNK2BCSNK2A1KDM4ECYP3A4
SCHEMBL17786530 0.85 CSNK2A2 (0.65) CSNK2A2CSNK2BCSNK2A1KDM4ECYP3A4
6,3'-Dimethoxyflavone SCHEMBL516389 0.83 KDM4E (0.82) CSNK2A2CSNK2BCSNK2A1KDM4ECYP3A4
6,3'-Dimethoxyflavone SCHEMBL30894690 0.83 KDM4E (0.82) CSNK2A2CSNK2BCSNK2A1KDM4ECYP3A4
SCHEMBL31675975 0.81 MAPT (1.00) CSNK2A2CSNK2BCSNK2A1KDM4ECYP3A4
SCHEMBL4649870 0.81 MAPT (1.00) CSNK2A2CSNK2BCSNK2A1KDM4ECYP3A4
SCHEMBL10632007 0.81 KDM4E (0.72) CSNK2A2CSNK2BCSNK2A1KDM4ECYP3A4
SCHEMBL17786425 0.81 KDM4E (0.60) CSNK2A2CSNK2BCSNK2A1KDM4ECYP3A4
SCHEMBL17786357 0.81 MAPT (0.69) CSNK2A2CSNK2BCSNK2A1KDM4ECYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2016083490-A1 COMPOUNDS FOR THE TREATMENT OF AMYLOID-ASSOCIATED DISEASES REMYND NV (BE) 2016-06-02 — — WO disclosed
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