SCHEMBL27708191

SCHEMBL27708191

CC(C(=O)C(C)c1cnc(Cl)s1)c1cnc(Cl)s1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK2 P24941 7/20 0.38
CCNE1 P24864 6/20 0.38
CDK5 Q00535 6/20 0.38
L3MBTL1 Q9Y468 3/20 0.37
ALDH1A1 P00352 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
CCNT1 O60563 1/20 0.34
CDK1 P06493 1/20 0.34
CDK4 P11802 1/20 0.34
CCNB1 P14635 1/20 0.34
CCNA2 P20248 1/20 0.34
CCND1 P24385 1/20 0.34
CDK7 P50613 1/20 0.34
CDK9 P50750 1/20 0.34
CCNH P51946 1/20 0.34
MNAT1 P51948 1/20 0.34
CDK5R1 Q15078 1/20 0.34
KMT2A Q03164 2/20 0.33
MEN1 O00255 1/20 0.33
FDPS P14324 1/20 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
SCHEMBL27828613 0.78 CDK2 (0.39) CDK2CCNE1CDK5ALDH1A1SMN1; SMN2
SCHEMBL10184044 0.78
SCHEMBL12671951 0.77
SCHEMBL7999561 0.75
SCHEMBL29001067 0.74 L3MBTL1 (0.35) L3MBTL1ALDH1A1SMN1; SMN2KMT2AMEN1
SCHEMBL27660062 0.74
SCHEMBL10184046 0.74
SCHEMBL27708192 0.73 MEN1 (0.34) CDK2CCNE1CDK5L3MBTL1ALDH1A1
SCHEMBL13010777 0.71 L3MBTL1 (0.36) L3MBTL1ALDH1A1KMT2AMEN1POLB
SCHEMBL27688646 0.70 CCNE1 (0.33) CDK2CCNE1CDK5ALDH1A1SMN1; SMN2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101115749-B Aminopyrimidine compounds and methods of use AMGEN INC 2011-06-22 CN disclosed
CN-101115749-A Aminopyrimidine compounds and methods of use AMGEN INC (US) 2008-01-30 CN disclosed