SCHEMBL3477971

SCHEMBL3477971

O=C(NCCO)c1cccc(-c2cnc3c(NCC4CC4)nccn23)c1

nearest known ligand 0.64

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TTK P33981 13/20 0.64
FYN P06241 7/20 0.48

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
SCHEMBL3469963 0.90 TTK (0.60) TTKFYN
SCHEMBL11939385 0.87 TTK (0.51) TTKFYN
SCHEMBL3469452 0.86 TTK (0.64) TTKFYN
SCHEMBL11939527 0.82 TTK (0.53) TTKFYN
SCHEMBL13321774 0.82 TTK (0.49) TTKFYN
SCHEMBL12340253 0.82 TTK (0.64) TTKFYN
SCHEMBL3469144 0.81 TTK (0.61) TTKFYN
SCHEMBL3477967 0.80 FYN (0.49) TTKFYN
SCHEMBL3469619 0.79 TTK (0.59) TTKFYN
SCHEMBL3469526 0.78 TTK (0.48) TTKFYN

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