SCHEMBL31367065

SCHEMBL31367065

CCCN1CC(c2c(F)c(Cl)cc(C(C)n3nc(C)c4c(N)ncnc43)c2OCC)C1

nearest known ligand 0.73

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 18/20 0.73
KCNH2 Q12809 1/20 0.73
AXL P30530 2/20 0.60
MERTK Q12866 2/20 0.60

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
SCHEMBL14736376 0.94 PIK3CD (0.77) PIK3CDKCNH2
SCHEMBL14737302 0.93 PIK3CD (0.71) PIK3CDKCNH2AXLMERTK
SCHEMBL29836131 0.93 PIK3CD (0.71) PIK3CDKCNH2AXLMERTK
SCHEMBL14736202 0.93 PIK3CD (0.75) PIK3CDKCNH2
SCHEMBL31441224 0.92 PIK3CD (0.74) PIK3CDKCNH2AXLMERTK
SCHEMBL14736340 0.92 PIK3CD (0.74) PIK3CDKCNH2AXLMERTK
SCHEMBL29836170 0.92 PIK3CD (0.62) PIK3CDKCNH2AXLMERTK
SCHEMBL31367086 0.91 PIK3CD (0.72) PIK3CDKCNH2AXLMERTK
SCHEMBL30590244 0.91 PIK3CD (0.74) PIK3CDKCNH2
SCHEMBL29510882 0.91 PIK3CD (0.74) PIK3CDKCNH2

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
EP-3888657-B1 HETEROCYCLYLAMINES AS PI3K INHIBITORS INCYTE HOLDINGS CORP (US) 2025-03-19 EP disclosed