SCHEMBL10272209

SCHEMBL10272209

CSc1nc(Nc2ccc(N3CCN(C(C)=O)CC3)cc2)[nH]c(=O)c1C#N

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDK7 P50613 5/20 0.44
▸ FLT3 P36888 4/20 0.44
▸ CCNH P51946 4/20 0.44
▸ CDK2 P24941 4/20 0.44
▸ MNAT1 P51948 3/20 0.44
▸ CCNE1 P24864 2/20 0.44
▸ MAPT P10636 6/20 0.44
▸ MEN1 O00255 2/20 0.44
▸ KMT2A Q03164 2/20 0.44
▸ ALK Q9UM73 1/20 0.44
▸ CDK1 P06493 5/20 0.44
▸ CCNB1 P14635 4/20 0.44
▸ SYK P43405 5/20 0.43
▸ CDK9 P50750 2/20 0.42
▸ CCNT1 O60563 1/20 0.42
▸ CCNA2 P20248 1/20 0.42
▸ CCNA1 P78396 1/20 0.42
▸ GAA P10253 6/20 0.41
▸ ALOX15 P16050 4/20 0.41
▸ ALOX12 P18054 4/20 0.41

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
SCHEMBL10272211 0.83 SYK (0.49) MAPTMEN1KMT2AALKSYK
SCHEMBL10271843 0.75 GAA (0.43) MAPTMEN1KMT2AGAAKDM4E
SCHEMBL2719026 0.74 SYK (0.57) MAPTMEN1KMT2AALKSYK
SCHEMBL10272210 0.73 CA2 (0.53) CDK2MEN1KMT2ACCNA2CCNA1
SCHEMBL2716442 0.70 SYK (0.60) SYK
SCHEMBL2728249 0.70 SYK (0.53) ALKSYK
SCHEMBL4381741 0.69 EGFR (0.51) CDK7FLT3CDK2CCNE1MAPT
SCHEMBL2729750 0.69 SYK (0.61) SYK
SCHEMBL760647 0.67 SYK (0.76) SYK
SCHEMBL10272163 0.67 GAA (0.56) MAPTMEN1KMT2AGAAKDM4E

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-2012061415-A1 OXYPYRIMIDINES AS SYK MODULATORS PORTOLA PHARMACEUTICALS, INC. (US) 2012-05-10 — — WO disclosed
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