SCHEMBL14573298

SCHEMBL14573298

C=C(COCCc1cc(Cl)ccc1F)Nc1ccc(-c2cnc3c(NC)nccn23)cc1

nearest known ligand 0.42

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ TTK P33981 15/20 0.42
▸ BRAF P15056 1/20 0.36
▸ FLT3 P36888 1/20 0.35
▸ ADORA3 P0DMS8 1/20 0.32
▸ PTK6 Q13882 1/20 0.32

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
SCHEMBL5619411 0.91 TTK (0.46) TTKBRAFFLT3PTK6
SCHEMBL5618400 0.80 TTK (0.48) TTKFLT3
SCHEMBL5618158 0.76 TTK (0.49) TTKBRAFFLT3
SCHEMBL5619480 0.72 TTK (0.49) TTKBRAFFLT3PTK6
SCHEMBL5618333 0.71 TTK (0.55) TTKBRAFFLT3PTK6
SCHEMBL5618727 0.71 TTK (0.50) TTKBRAFFLT3
SCHEMBL5617963 0.70 TTK (0.55) TTKBRAFFLT3
SCHEMBL5406217 0.69 FLT3 (0.53) TTKFLT3
SCHEMBL5618058 0.69 TTK (0.53) TTKBRAF
SCHEMBL5618446 0.69 TTK (0.57) TTK

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
US-7186832-B2 Use of 8-amino-aryl-substituted imidazopyrazines as kinase inhibitors SUGEN INC. (US) 2007-03-06 — — US disclosed
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