SCHEMBL31367068

SCHEMBL31367068

COc1c(C(C)n2nc(C)c3cncnc32)cc(Cl)c(C)c1C1CN(C2CCOC2)C1

nearest known ligand 0.58

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 16/20 0.58
AXL P30530 4/20 0.43
MERTK Q12866 4/20 0.43

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
SCHEMBL31441228 0.88 PIK3CD (0.77) PIK3CDAXLMERTK
SCHEMBL14736200 0.88 PIK3CD (0.77) PIK3CDAXLMERTK
SCHEMBL30340329 0.85 PIK3CD (0.63) PIK3CDAXLMERTK
SCHEMBL31441215 0.83 PIK3CD (0.79) PIK3CDAXLMERTK
SCHEMBL14736985 0.83 PIK3CD (0.79) PIK3CDAXLMERTK
SCHEMBL31367075 0.82 PIK3CD (0.60) PIK3CDAXLMERTK
SCHEMBL14736304 0.82 PIK3CD (0.78) PIK3CDAXLMERTK
SCHEMBL31367081 0.82 PIK3CD (0.59) PIK3CDAXLMERTK
SCHEMBL29836174 0.82 PIK3CD (0.59) PIK3CDAXLMERTK
SCHEMBL31367091 0.81 PIK3CD (0.59) 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