SCHEMBL15547007

SCHEMBL15547007

COC(=O)C1CCC(Cn2c(=O)c3ccccc3n(Cc3cccc(C(F)(F)F)c3F)c2=O)CC1

nearest known ligand 0.64

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ TNKS O95271 18/20 0.64
▸ TNKS2 Q9H2K2 18/20 0.64
▸ CYP2C9 P11712 1/20 0.51
▸ CYP2C19 P33261 1/20 0.51

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
SCHEMBL15547009 1.00 TNKS (0.64) TNKSTNKS2CYP2C9CYP2C19
SCHEMBL15547644 0.89 TNKS (0.82) TNKSTNKS2CYP2C9CYP2C19
SCHEMBL15547646 0.89 TNKS (0.82) TNKSTNKS2CYP2C9CYP2C19
SCHEMBL15547901 0.88 TNKS (0.69) TNKSTNKS2CYP2C9CYP2C19
SCHEMBL15547902 0.88 TNKS (0.69) TNKSTNKS2CYP2C9CYP2C19
SCHEMBL15548311 0.80 TNKS (0.68) TNKSTNKS2CYP2C9CYP2C19
SCHEMBL15548312 0.80 TNKS (0.68) TNKSTNKS2CYP2C9CYP2C19
SCHEMBL15547980 0.79 TNKS (0.83) TNKSTNKS2CYP2C9CYP2C19
SCHEMBL15547983 0.79 TNKS (0.83) TNKSTNKS2CYP2C9CYP2C19
SCHEMBL15534915 0.78 TNKS (1.00) TNKSTNKS2CYP2C9CYP2C19

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-2013177349-A2 QUINAZOLINEDIONES AS TANKYRASE INHIBITORS GLAXOSMITHKLINE LLC (US) 2013-11-28 — — WO disclosed
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