SCHEMBL14447403

SCHEMBL14447403

C[C@H]1CCC(n2ccc3c(N)ncnc32)C1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.43
ADK P55263 1/20 0.43
PRMT5 O14744 11/20 0.43
WDR77 Q9BQA1 8/20 0.43
PIK3CD O00329 2/20 0.43
ABL1 P00519 2/20 0.43
EGFR P00533 2/20 0.43
HCK P08631 2/20 0.43
SRC P12931 2/20 0.43
KDR P35968 2/20 0.43
PIK3CA P42336 2/20 0.43
PIK3CB P42338 2/20 0.43
MTOR P42345 2/20 0.43
PIK3CG P48736 2/20 0.43
EPHB4 P54760 2/20 0.43
PRKDC P78527 2/20 0.43
PI4KB Q9UBF8 2/20 0.43
ADORA2A P29274 1/20 0.42
PIP4K2A P48426 1/20 0.41

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
SCHEMBL25049134 0.83 PIP4K2A (0.46) PRMT5WDR77PIK3CDABL1EGFR
SCHEMBL10293822 0.81 PIP4K2A (0.49) PRMT5WDR77PIP4K2A
SCHEMBL10293819 0.81 MEN1 (0.47) MEN1ADKPRMT5WDR77ADORA2A
SCHEMBL25047848 0.81 ADK (0.50) MEN1ADKPRMT5WDR77ADORA2A
SCHEMBL10242174 0.81 ADORA2A (0.56) MEN1ADKPRMT5WDR77ABL1
SCHEMBL19344041 0.80 ADCY5 (0.47) MEN1ADKPRMT5WDR77ABL1
SCHEMBL10236925 0.80 ADCY5 (0.47) MEN1ADKPRMT5WDR77ABL1
SCHEMBL23584600 0.80 ADCY5 (0.47) MEN1ADKPRMT5WDR77ABL1
SCHEMBL18571704 0.80 MEN1 (0.41) MEN1ADKPRMT5WDR77ADORA2A
SCHEMBL25048759 0.80 ADCY5 (0.42) MEN1ADKPRMT5WDR77

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-2007092213-A2 INHIBITORS OF E1 ACTIVATING ENZYME MILLENNIUM PHARMACEUTICALS, INC. (US) 2007-08-16 WO disclosed