SCHEMBL3467955

SCHEMBL3467955

Cc1ccc(S(=O)(=O)Nc2ccc(Nc3nccn4c(-c5ccc(C(=O)NCCN(C)C)cc5)cnc34)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ TTK P33981 10/20 0.50
▸ AURKA O14965 1/20 0.47
▸ FYN P06241 3/20 0.45
▸ KMT2A Q03164 3/20 0.45
▸ TDP1 Q9NUW8 1/20 0.45
▸ MEN1 O00255 2/20 0.44
▸ KDM4E B2RXH2 1/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ GAA P10253 1/20 0.44
▸ RAD52 P43351 2/20 0.43

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
SCHEMBL3469340 0.81 FYN (0.62) TTKFYNRAD52
SCHEMBL25013801 0.80 TTK (0.57) TTKAURKA
SCHEMBL4394379 0.78 TTK (0.49) TTKAURKAALDH1A1RAD52
SCHEMBL3469358 0.78 TTK (0.49) TTKFYNRAD52
SCHEMBL25014253 0.77 TTK (0.56) TTKAURKAALDH1A1
SCHEMBL14164724 0.76 AURKA (0.49) TTKAURKAKMT2ATDP1MEN1
SCHEMBL14240757 0.76 AURKA (0.50) TTKAURKAFYNKMT2AMEN1
SCHEMBL4338168 0.75 PIM1 (0.62) AURKAFYNKMT2ATDP1MEN1
SCHEMBL25013288 0.74 TTK (0.47) TTK
SCHEMBL5576245 0.74 TTK (0.54) TTKTDP1ALDH1A1

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
WO-2010069684-A1 COMPOUNDS FOR TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY BIOMARIN IGA, LTD. (BS) 2010-06-24 — — WO claimed
WO-2010069684-A1 COMPOUNDS FOR TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY BIOMARIN IGA, LTD. (BS) 2010-06-24 — — WO disclosed
WO-2010069684-A1 COMPOUNDS FOR TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY BIOMARIN IGA, LTD. (BS) 2010-06-24 — — WO disclosed
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