SCHEMBL11320094

SCHEMBL11320094

C[Si](C)(C)CCOCn1nc(-c2cccc(NCc3ccsc3)n2)c2cnc(NC3CCC(NC(=O)O)CC3)nc21

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CCNT1 O60563 3/20 0.37
▸ MERTK Q12866 12/20 0.35
▸ AXL P30530 3/20 0.33
▸ TYRO3 Q06418 3/20 0.33
▸ FLT3 P36888 2/20 0.33
▸ CCNE2 O96020 3/20 0.33
▸ CCNA2 P20248 3/20 0.33
▸ CCNE1 P24864 3/20 0.33
▸ CDK2 P24941 3/20 0.33
▸ CCNA1 P78396 3/20 0.33

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
SCHEMBL10322947 0.92 CCNT1 (0.35) CCNT1MERTKFLT3
SCHEMBL10323252 0.81 MERTK (0.36) MERTKAXLTYRO3CCNE2CCNA2
SCHEMBL10322157 0.80 MERTK (0.43) CCNT1MERTKAXLTYRO3FLT3
SCHEMBL10323155 0.76 MERTK (0.37) MERTKAXLTYRO3
SCHEMBL10322433 0.75 MERTK (0.36) MERTKAXLTYRO3FLT3
SCHEMBL10322642 0.73 MERTK (0.41) MERTKAXLTYRO3CCNE2CCNA2
SCHEMBL10324425 0.73 MERTK (0.50) MERTKAXLTYRO3
SCHEMBL10324360 0.72 MERTK (0.41) CCNT1MERTKAXLTYRO3FLT3
SCHEMBL10323426 0.71 MERTK (0.37) MERTKAXLTYRO3FLT3
SCHEMBL10322741 0.71 MERTK (0.49) CCNT1MERTKAXLTYRO3FLT3

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-2012098068-A1 PYRAZOLO PYRIMIDINES AS DYRK1A AND DYRK1B INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2012-07-26 — — WO disclosed
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