SCHEMBL30984258

SCHEMBL30984258

CCc1c(N2CCN(c3nocc3O)CC2)c(=O)n2nc(C3=CCOCC3)nc2n1CC(=O)Nc1ccc(C(F)(F)F)cc1Cl

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ WRN Q14191 1/20 0.73
▸ ACHE P22303 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.32
▸ ALDH1A1 P00352 6/20 0.32
▸ TSHR P16473 4/20 0.32
▸ MAPT P10636 2/20 0.32
▸ NPSR1 Q6W5P4 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ USP2 O75604 1/20 0.32
▸ CYP1A2 P05177 1/20 0.32
▸ CYP3A4 P08684 1/20 0.32
▸ CYP2D6 P10635 1/20 0.32
▸ CYP2C19 P33261 1/20 0.32
▸ LMNA P02545 3/20 0.31
▸ CNR2 P34972 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ GAA P10253 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
SCHEMBL30984197 0.94 WRN (0.67) WRNPOLBL3MBTL1HSD17B10ALDH1A1
SCHEMBL30984157 0.93 WRN (0.66) WRNACHEPOLBL3MBTL1
SCHEMBL30984224 0.91 WRN (0.61) WRN
SCHEMBL30984283 0.90 WRN (0.60) WRN
SCHEMBL27379033 0.90 WRN (0.79) WRNACHEPOLBL3MBTL1HSD17B10
SCHEMBL31394634 0.90 WRN (0.79) WRNACHEPOLBL3MBTL1HSD17B10
SCHEMBL25035189 0.89 WRN (0.74) WRNACHEPOLBL3MBTL1HSD17B10
SCHEMBL30037352 0.89 WRN (0.74) WRNACHEPOLBL3MBTL1HSD17B10
SCHEMBL31394301 0.89 WRN (0.74) WRNACHEPOLBL3MBTL1HSD17B10
SCHEMBL31394623 0.89 WRN (0.78) WRNACHEPOLBL3MBTL1HSD17B10

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-2024153155-A1 DOUBLE-HETEROCYCLIC WRN INHIBITOR, AND PREPARATION METHOD THEREFOR AND USE THEREOF 成都微芯药业有限公司 2024-07-25 — — WO disclosed
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