SCHEMBL3469358

SCHEMBL3469358

CN(C)CCNC(=O)c1ccc(-c2cnc3c(Nc4ccc5[nH]ccc5c4)nccn23)cc1

nearest known ligand 0.49

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ TTK P33981 12/20 0.49
▸ FYN P06241 5/20 0.46
▸ RAD52 P43351 2/20 0.44
▸ BRAF P15056 1/20 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 0.80 FYN (0.62) TTKFYNRAD52
SCHEMBL2401175 0.80 MAPKAPK5 (0.60) TTK
SCHEMBL3467955 0.78 TTK (0.50) TTKFYNRAD52
SCHEMBL3469410 0.75 RAD52 (0.62) FYNRAD52BRAF
SCHEMBL8241606 0.74 AURKA (0.58) —
SCHEMBL15858028 0.74 BRAF (0.50) BRAF
SCHEMBL3469745 0.74 ABL1 (0.51) TTK
SCHEMBL1674115 0.74 MAPKAPK5 (0.57) TTK
SCHEMBL22122904 0.74 FYN (0.52) TTKFYNRAD52
SCHEMBL30172068 0.74 FYN (0.52) TTKFYNRAD52

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
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
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