SCHEMBL20052007

SCHEMBL20052007

CC(C)C(=O)Nc1nc2c(ncn2[C@@H](COC(=O)c2ccccc2)O[C@H](C)COP(C)OCCC#N)c(=O)[nH]1

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ TSHR P16473 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ NOS1 P29475 1/20 0.31
▸ CCNB2 O95067 1/20 0.30
▸ CDK1 P06493 1/20 0.30
▸ CCNB1 P14635 1/20 0.30
▸ CDK5 Q00535 1/20 0.30
▸ CDK5R1 Q15078 1/20 0.30
▸ CCNB3 Q8WWL7 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
SCHEMBL14867658 0.96 KDM4E (0.35) KDM4EL3MBTL1MEN1TSHRKMT2A
SCHEMBL13443499 0.85 L3MBTL1 (0.36) KDM4EL3MBTL1MEN1TSHRKMT2A
SCHEMBL20052006 0.84 KDM4E (0.40) KDM4EL3MBTL1MEN1TSHRKMT2A
SCHEMBL17014883 0.82 KDM4E (0.39) KDM4EMEN1TSHRKMT2ANOS1
SCHEMBL14867659 0.82 KDM4E (0.39) KDM4EL3MBTL1MEN1TSHRKMT2A
SCHEMBL20051998 0.81 CCNB2 (0.35) KDM4EL3MBTL1MEN1KMT2ACCNB2
SCHEMBL13443496 0.79 POLB (0.42) KDM4EL3MBTL1MEN1TSHRKMT2A
SCHEMBL14867641 0.77 CCNB2 (0.32) L3MBTL1CCNB2CDK1CCNB1CDK5
SCHEMBL20052008 0.76 POLB (0.52) —
SCHEMBL20052002 0.75 POLB (0.32) —

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
US-9944929-B2 UNA single stranded oligomers for therapeutics ARCTURUS THERAPEUTICS, INC. (US) 2018-04-17 — — US disclosed
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