SCHEMBL30783932

SCHEMBL30783932

CCn1c(N2CCOCC2)nc2c(C(C)N)cc(C)cc2c1=O

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ PIK3CB P42338 16/20 0.38
▸ AKT1 P31749 1/20 0.37
▸ AKT2 P31751 1/20 0.37
▸ AKT3 Q9Y243 1/20 0.37
▸ POLB P06746 1/20 0.37
▸ MAPK1 P28482 1/20 0.37
▸ DPP4 P27487 1/20 0.36
▸ GAA P10253 1/20 0.36
▸ PIK3CD O00329 1/20 0.35
▸ PIK3CA P42336 1/20 0.35
▸ PIK3CG P48736 1/20 0.35
▸ PRKDC P78527 1/20 0.35

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
SCHEMBL30783939 0.96 PIK3CB (0.40) PIK3CBAKT1AKT2AKT3POLB
SCHEMBL30783599 0.89 PIK3CB (0.37) PIK3CBAKT1AKT2AKT3POLB
SCHEMBL30784386 0.88 DPP4 (0.37) PIK3CBPOLBMAPK1DPP4GAA
SCHEMBL30784369 0.88 PIK3CB (0.38) PIK3CBAKT1AKT2AKT3
SCHEMBL30783773 0.87 CYP1A2 (0.44) PIK3CBAKT1AKT2AKT3POLB
SCHEMBL30784539 0.86 PDE1A (0.42) PIK3CBAKT1AKT2AKT3
SCHEMBL30783583 0.86 AKT1 (0.47) PIK3CBAKT1AKT2AKT3PIK3CD
SCHEMBL30784348 0.86 AKT1 (0.47) PIK3CBAKT1AKT2AKT3PIK3CD
SCHEMBL30783689 0.85 PIK3CB (0.39) PIK3CBAKT1AKT2AKT3PIK3CD
SCHEMBL30784279 0.82 PIM1 (0.42) PIK3CBDPP4GAA

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-2024026424-A1 QUINAZOLINONE DERIVATIVES AS AND RELATED USES BLACK DIAMOND THERAPEUTICS, INC. (US) 2024-02-01 — — WO disclosed
Send feedback