SCHEMBL27381970

SCHEMBL27381970

CC(=O)N1CCN(c2c(C3CC3)n(CC(=O)Nc3ccc(C(F)(F)F)cc3)c3nc(C4=CCOCC4)nn3c2=O)CC1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ WRN Q14191 1/20 0.53
▸ FPR2 P25090 1/20 0.37
▸ EPHX2 P34913 2/20 0.36
▸ PIK3CA P42336 1/20 0.35
▸ MTOR P42345 1/20 0.35
▸ LMNA P02545 3/20 0.34
▸ MAPT P10636 3/20 0.34
▸ ENPP2 Q13822 3/20 0.34
▸ KMT2A Q03164 2/20 0.33
▸ MAP3K12 Q12852 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ POLB P06746 1/20 0.33
▸ CA1 P00915 1/20 0.33
▸ CA2 P00918 1/20 0.33
▸ CA7 P43166 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ SMN1; SMN2 Q16637 2/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.33
▸ NR3C1 P04150 1/20 0.32
▸ TP53 P04637 1/20 0.32

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
SCHEMBL27379356 0.91 WRN (0.56) WRNFPR2EPHX2PIK3CAMTOR
SCHEMBL25035217 0.91 WRN (0.49) WRNPIK3CAMTORLMNAMAPT
SCHEMBL27378955 0.90 WRN (0.64) WRNFPR2EPHX2PIK3CAMTOR
SCHEMBL25037061 0.88 WRN (0.55) WRNEPHX2PIK3CAMTORCA1
SCHEMBL27381697 0.86 WRN (0.47) WRNFPR2EPHX2PIK3CAMTOR
SCHEMBL25037184 0.86 WRN (0.45) WRNPIK3CAMTORLMNAMAPT
SCHEMBL30862836 0.85 WRN (0.46) WRNFPR2EPHX2PIK3CAMTOR
SCHEMBL27386392 0.85 WRN (0.46) WRNFPR2EPHX2PIK3CAMTOR
SCHEMBL25036831 0.83 WRN (0.54) WRNMTORLMNAMAPTKMT2A
SCHEMBL27379214 0.83 WRN (0.50) WRNPIK3CAMTORLMNAMAPT

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4619104-A1 BICYCLIC HETEROCYCLES AND THEIR USE AS WRN INHIBITORS Novartis AG (CH) 2025-09-24 — — EP disclosed
WO-2024105553-A1 BICYCLIC HETEROCYCLES AND THEIR USE AS WRN INHIBITORS NOVARTIS AG (CH) 2024-05-23 — — WO disclosed
WO-2024105553-A1 BICYCLIC HETEROCYCLES AND THEIR USE AS WRN INHIBITORS NOVARTIS AG (CH) 2024-05-23 — — WO disclosed
Send feedback