SCHEMBL15028120

SCHEMBL15028120

CC(CO)n1cnc2c(NCCc3c[nH]c4c3CCC=C4)nc(-c3cncc(F)c3)nc21

nearest known ligand 0.33

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ CDK5 Q00535 8/20 0.33
▸ CDK5R1 Q15078 8/20 0.33
▸ CCNB2 O95067 6/20 0.33
▸ CDK1 P06493 6/20 0.33
▸ CCNB1 P14635 6/20 0.33
▸ CCNB3 Q8WWL7 6/20 0.33
▸ CCNK O75909 1/20 0.32
▸ CDK12 Q9NYV4 1/20 0.32
▸ CCNE1 P24864 3/20 0.32
▸ CDK2 P24941 3/20 0.32
▸ CCNT1 O60563 2/20 0.32
▸ CDK9 P50750 2/20 0.32
▸ CDK7 P50613 1/20 0.31
▸ CCNH P51946 1/20 0.31
▸ AHR P35869 1/20 0.30
▸ CCNE2 O96020 1/20 0.30

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
SCHEMBL15028075 1.00 CDK5 (0.33) CDK5CDK5R1CCNB2CDK1CCNB1
SCHEMBL15028204 0.82 MEN1 (0.31) —
SCHEMBL21253842 0.82 CDK5 (0.41) CDK5CDK5R1CCNB2CDK1CCNB1
SCHEMBL2359481 0.81 CCNE2 (0.48) CCNE1CDK2AHRCCNE2
SCHEMBL20895830 0.81 CCNE2 (0.48) CCNE1CDK2AHRCCNE2
SCHEMBL2317462 0.81 CCNE2 (0.48) CCNE1CDK2AHRCCNE2
SCHEMBL20895831 0.81 CCNE2 (0.48) CCNE1CDK2AHRCCNE2
SCHEMBL2317472 0.81 CCNE2 (0.48) CCNE1CDK2AHRCCNE2
SCHEMBL30476574 0.81 CCNE2 (0.48) CCNE1CDK2AHRCCNE2
SCHEMBL30013436 0.81 CCNE2 (0.48) CCNE1CDK2AHRCCNE2

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-2013086436-A1 COMPOSITIONS AND METHODS FOR ENHANCED GENERATION OF HEMATOPOIETIC STEM/PROGENITOR CELLS FRED HUTCHINSON CANCER RESEARCH CENTER (US) 2013-06-13 — — WO disclosed
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