SCHEMBL31315568

SCHEMBL31315568

Cc1nccn1Cc1cc2c(c(-c3cn(C)nc3C(F)(F)F)c1)OCCC2=O

nearest known ligand 0.59

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
WDR5 P61964 15/20 0.59
PDE3B Q13370 1/20 0.35
PDE3A Q14432 1/20 0.35
KCNH2 Q12809 3/20 0.34
EED O75530 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
SCHEMBL25188022 1.00 WDR5 (0.59) WDR5PDE3BPDE3AKCNH2EED
SCHEMBL25187166 0.89 WDR5 (0.54) WDR5
SCHEMBL22750309 0.88 WDR5 (0.57) WDR5PDE3BPDE3AKCNH2
SCHEMBL29767270 0.88 WDR5 (0.57) WDR5PDE3BPDE3AKCNH2
SCHEMBL22766405 0.81 WDR5 (0.78) WDR5KCNH2
SCHEMBL29767249 0.81 WDR5 (0.78) WDR5KCNH2
SCHEMBL22750297 0.80 WDR5 (0.64) WDR5KCNH2
SCHEMBL29767087 0.80 WDR5 (0.64) WDR5KCNH2
SCHEMBL24885723 0.79 WDR5 (0.68) WDR5
SCHEMBL24886267 0.79 WDR5 (0.66) WDR5PDE3BPDE3AKCNH2

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-2024232597-A1 4-CHROMANONE COMPOUNDS THAT DEGRADE WDR5 AND USES THEREOF 엘젠테라퓨틱스 주식회사 2024-11-14 WO disclosed