SCHEMBL28700929

SCHEMBL28700929

NC1=Nc2c[c]ccc2C2=NCCN12

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DNMT1 P26358 1/20 0.37
RAD52 P43351 1/20 0.37
UHRF1 Q96T88 1/20 0.37
HDAC8 Q9BY41 6/20 0.33
HDAC4 P56524 4/20 0.33
SIGMAR1 Q99720 2/20 0.33
PTAFR P25105 6/20 0.33
SMARCA2 P51531 1/20 0.32
HDAC6 Q9UBN7 2/20 0.32
HDAC1 Q13547 1/20 0.32
HDAC7 Q8WUI4 1/20 0.32
HDAC5 Q9UQL6 1/20 0.32
EED O75530 1/20 0.31

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
SCHEMBL12362300 0.62 HDAC8 (0.37) DNMT1RAD52UHRF1HDAC8HDAC4
SCHEMBL22716966 0.61 CTSD (0.37)
SCHEMBL7326935 0.60 DNMT1 (0.51) DNMT1RAD52UHRF1HDAC8HDAC4
SCHEMBL22716968 0.59 NOS1 (0.40)
SCHEMBL31167506 0.57 HDAC8 (0.57) HDAC8HDAC4PTAFRSMARCA2HDAC6
SCHEMBL21054186 0.56 CA2 (0.31)
SCHEMBL2493946 0.55 DNMT1 (0.62) DNMT1RAD52UHRF1HDAC8HDAC4
SCHEMBL6160294 0.54 NOS3 (0.56)
SCHEMBL27208844 0.54 IDO1 (0.31)
SCHEMBL1028400 0.53 LGMN (0.50)

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-114126614-A Heterocyclic compounds as PRMT5 inhibitors 安杰斯制药公司 2022-03-01 CN claimed
CN-114126614-A Heterocyclic compounds as PRMT5 inhibitors 安杰斯制药公司 2022-03-01 CN disclosed