SCHEMBL29144306

SCHEMBL29144306

CN(C)C(=O)c1ccc2c(c1)CCNC2=O

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PARP11 Q9NR21 10/20 0.56
PARP10 Q53GL7 10/20 0.56
PRKACA P17612 1/20 0.49
PRKACG P22612 1/20 0.49
PRKACB P22694 1/20 0.49
PARP1 P09874 2/20 0.46
PDPK1 O15530 1/20 0.46
GRM5 P41594 7/20 0.46
GSK3B P49841 1/20 0.43

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
SCHEMBL23136956 0.85 SMYD3 (0.50) PARP1GRM5GSK3B
SCHEMBL1727165 0.83 PARP11 (0.72) PARP11PARP10PRKACAPRKACGPRKACB
SCHEMBL30337030 0.81 PARP11 (0.58) PARP11PARP10PRKACAPRKACGPRKACB
SCHEMBL1417726 0.81 PARP11 (0.58) PARP11PARP10PRKACAPRKACGPRKACB
SCHEMBL8511891 0.80 KDM4E (0.54)
SCHEMBL30421037 0.80 PARP10 (0.57) PARP11PARP10PRKACAPRKACGPRKACB
SCHEMBL12683051 0.79 PRKACA (0.58) PARP11PARP10PRKACAPRKACGPRKACB
SCHEMBL30336933 0.79 PRKACA (0.58) PARP11PARP10PRKACAPRKACGPRKACB
SCHEMBL12810163 0.78 PARP10 (0.54) PARP11PARP10PRKACAPRKACGPRKACB
SCHEMBL15880055 0.77 CRBN (0.43)

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
CN-117242073-A PRMT5 inhibitors and uses thereof 海思科医药集团股份有限公司 2023-12-15 CN disclosed