SCHEMBL31367083

SCHEMBL31367083

COc1c(C(C)n2nc(C)c3c(N)ncnc32)cc(Cl)c(C)c1C1CN(CCC(F)(F)F)C1

nearest known ligand 0.75

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 16/20 0.75
AXL P30530 4/20 0.68
MERTK Q12866 4/20 0.68

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
SCHEMBL30340320 0.92 PIK3CD (0.78) PIK3CDAXLMERTK
SCHEMBL14736539 0.92 PIK3CD (0.78) PIK3CDAXLMERTK
SCHEMBL31367085 0.90 PIK3CD (0.80) PIK3CDAXLMERTK
SCHEMBL16005855 0.90 PIK3CD (0.80) PIK3CDAXLMERTK
SCHEMBL14736418 0.89 AXL (0.81) PIK3CDAXLMERTK
SCHEMBL31441227 0.89 PIK3CD (0.79) PIK3CDAXLMERTK
SCHEMBL14736659 0.89 PIK3CD (0.79) PIK3CDAXLMERTK
SCHEMBL14736873 0.89 PIK3CD (0.88) PIK3CDAXLMERTK
SCHEMBL30590335 0.89 PIK3CD (0.88) PIK3CDAXLMERTK
SCHEMBL14736329 0.88 PIK3CD (0.83) PIK3CDAXLMERTK

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