SCHEMBL14148129

SCHEMBL14148129

Bc1ccc2c(c1)CCc1ncnc(Cl)c1-2

nearest known ligand 0.35

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TYMS P04818 1/20 0.35

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
SCHEMBL14148150 0.82
SCHEMBL4737413 0.82 TYMS (0.46) TYMS
SCHEMBL14148127 0.72 FGFR1 (0.37)
SCHEMBL13070957 0.70 CASP1 (0.37)
SCHEMBL4740750 0.64 TYMS (0.46) TYMS
SCHEMBL13363063 0.62 CASP1 (0.31)
SCHEMBL883774 0.62 CASP1 (0.59)
SCHEMBL14345773 0.62 CASP1 (0.31)
SCHEMBL14148121 0.61 TYMS (0.63) TYMS
SCHEMBL19417397 0.60 SRD5A1 (0.53) TYMS

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-2008086158-A1 BENZODIHYDROQUINAZOLINE AS PI3 KINASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2008-07-17 WO disclosed