SCHEMBL30845796

SCHEMBL30845796

Cn1cc(-c2ccc3nc(C(N)=O)cn3n2)cn1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 3/20 0.49
PIK3CG P48736 1/20 0.49
IRAK4 Q9NWZ3 1/20 0.46
CCNC P24863 1/20 0.46
CDK8 P49336 1/20 0.46
FYN P06241 5/20 0.45
CHEK1 O14757 1/20 0.45
CSNK1D P48730 2/20 0.43
CSNK1E P49674 2/20 0.43
STING1 Q86WV6 1/20 0.43
MKNK1 Q9BUB5 1/20 0.42
MKNK2 Q9HBH9 1/20 0.42
RIPK1 Q13546 3/20 0.42
GRK5 P34947 1/20 0.42

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
SCHEMBL21033596 0.90 PIK3CG (0.51) GRM2PIK3CGIRAK4CCNCCDK8
SCHEMBL21033576 0.82 KDM4E (0.60) PIK3CGFYNCHEK1RIPK1
SCHEMBL21033570 0.78 FYN (0.42) PIK3CGFYNCHEK1RIPK1GRK5
SCHEMBL30845750 0.77 KDM4E (0.38) CDK8CSNK1DCSNK1E
SCHEMBL29908155 0.76 USP30 (0.54) GRM2PIK3CGCCNCCDK8MKNK1
SCHEMBL30828852 0.75 GRM2 (0.44) GRM2IRAK4CCNCCDK8FYN
SCHEMBL29502453 0.75 IRAK4 (0.67) GRM2IRAK4CCNCCDK8CHEK1
SCHEMBL22835312 0.75 IRAK4 (0.67) GRM2IRAK4CCNCCDK8CHEK1
SCHEMBL30845759 0.75 GRM2 (0.47) GRM2PIK3CGIRAK4CCNCCDK8
SCHEMBL21639192 0.73 AHR (0.50) CDK8FYN

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-111542523-B Heterocyclic compounds as PRMT5 inhibitors 朱比连特埃皮斯科瑞有限责任公司 2024-03-29 CN claimed
CN-111542523-B Heterocyclic compounds as PRMT5 inhibitors 朱比连特埃皮斯科瑞有限责任公司 2024-03-29 CN disclosed