SCHEMBL30752865

SCHEMBL30752865

CC(C)(C)OC(=O)NCc1n[nH]c(=O)c2c(I)cc(Br)cc12

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ PRMT5 O14744 9/20 0.50
▸ WDR77 Q9BQA1 9/20 0.50
▸ PARP1 P09874 3/20 0.43
▸ KDM4E B2RXH2 1/20 0.38
▸ LMNA P02545 1/20 0.38
▸ KDM4A O75164 1/20 0.35
▸ GFER P55789 2/20 0.35
▸ CYP1A2 P05177 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ FPR3 P25089 1/20 0.34
▸ FPR2 P25090 1/20 0.34

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
SCHEMBL27386026 0.87 PRMT5 (0.50) PRMT5WDR77PARP1KDM4ELMNA
SCHEMBL27385996 0.85 PRMT5 (0.48) PRMT5WDR77PARP1KDM4ELMNA
SCHEMBL23087948 0.81 PRMT5 (0.66) PRMT5WDR77PARP1KDM4ELMNA
SCHEMBL25581278 0.81 ADORA1 (0.33) PRMT5WDR77
SCHEMBL30752999 0.80 PRMT5 (0.44) PRMT5WDR77PARP1KDM4ELMNA
SCHEMBL30430242 0.80 PRMT5 (0.51) PRMT5WDR77PARP1KDM4ELMNA
SCHEMBL25581154 0.80 PRMT5 (0.51) PRMT5WDR77PARP1KDM4ELMNA
SCHEMBL31375967 0.79 PRMT5 (0.43) PRMT5WDR77PARP1KDM4ELMNA
SCHEMBL25218581 0.78 ADORA1 (0.31) PRMT5WDR77
SCHEMBL31376006 0.77 PRMT5 (0.51) PRMT5WDR77PARP1KDM4ELMNA

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-2024027703-A1 PRMT5 INHIBITOR, PREPARATION METHOD THEREFOR AND USE THEREOF 上海艾力斯医药科技股份有限公司 2024-02-08 — — WO disclosed
Send feedback