SCHEMBL30984191

SCHEMBL30984191

CCc1cc(=O)n2nc(C3=CCOCC3)nc2n1CC(=O)Nc1cc(F)c(C(F)(F)F)cc1Cl

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ WRN Q14191 1/20 0.49
▸ PIK3CD O00329 2/20 0.33
▸ PIK3C2B O00750 1/20 0.33
▸ PIK3CG P48736 1/20 0.33
▸ POLB P06746 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ WDR5 P61964 2/20 0.33
▸ PIK3CB P42338 1/20 0.33
▸ THRB P10828 1/20 0.33
▸ IDH2 P48735 3/20 0.32
▸ MAPT P10636 2/20 0.32
▸ TP53 P04637 1/20 0.32
▸ TRPV1 Q8NER1 1/20 0.30

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
SCHEMBL30984247 0.94 WRN (0.49) WRNPIK3CDPIK3C2BPIK3CGPOLB
SCHEMBL30984318 0.92 WRN (0.45) WRNPIK3CDPIK3C2BPIK3CGPOLB
SCHEMBL30984280 0.89 WRN (0.49) WRNPIK3CDPIK3C2BPIK3CGPOLB
SCHEMBL25036852 0.88 WRN (0.61) WRNPIK3CDPOLBL3MBTL1PIK3CB
SCHEMBL30038447 0.88 WRN (0.61) WRNPIK3CDPOLBL3MBTL1PIK3CB
SCHEMBL30984123 0.87 WRN (0.56) WRNPIK3CDPIK3C2BPIK3CGPOLB
SCHEMBL30984113 0.86 WRN (0.47) WRNPIK3CDPIK3C2BPIK3CGWDR5
SCHEMBL31295793 0.84 WRN (0.57) WRNPOLBL3MBTL1MAPTTP53
SCHEMBL25037235 0.83 WRN (0.61) WRNPIK3CDPIK3C2BPIK3CGPOLB
SCHEMBL30038616 0.83 WRN (0.61) WRNPIK3CDPIK3C2BPIK3CGPOLB

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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