SCHEMBL30455945

SCHEMBL30455945

NNc1nc(N2CCOCC2)c2cccnc2n1

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 16/20 0.60
MTOR P42345 14/20 0.60
PIK3CD O00329 3/20 0.60
PIK3CG P48736 2/20 0.60
PIK3R1 P27986 12/20 0.52
KDM4E B2RXH2 2/20 0.47
ALDH1A1 P00352 1/20 0.47
LMNA P02545 1/20 0.47
HPGD P15428 1/20 0.47
HTT P42858 1/20 0.47
ALOX15 P16050 1/20 0.46
MAPK1 P28482 1/20 0.46
METAP1 P53582 1/20 0.46
MAPT P10636 1/20 0.46
CHEK1 O14757 1/20 0.45

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
SCHEMBL25722311 1.00 PIK3CA (0.60) PIK3CAMTORPIK3CDPIK3CGPIK3R1
SCHEMBL27272628 0.80 PIK3CA (0.60) PIK3CAMTORPIK3CDPIK3CGPIK3R1
SCHEMBL25719399 0.80 PIK3CA (0.60) PIK3CAMTORPIK3CDPIK3CGPIK3R1
SCHEMBL25724481 0.80 PIK3CA (0.60) PIK3CAMTORPIK3CDPIK3CGPIK3R1
SCHEMBL16094600 0.80 PIK3CA (0.60) PIK3CAMTORPIK3CDPIK3CGPIK3R1
SCHEMBL25277910 0.79 PIK3CD (0.61) PIK3CAMTORPIK3CDPIK3CGPIK3R1
SCHEMBL258487 0.76 PIK3CA (0.74) PIK3CAMTORPIK3CDPIK3CGPIK3R1
SCHEMBL31705145 0.75 PTK2 (0.63) PIK3CAMTORPIK3CDPIK3CGPIK3R1
SCHEMBL25719397 0.75 PTK2 (0.63) PIK3CAMTORPIK3CDPIK3CGPIK3R1
SCHEMBL13610136 0.72 CHEK1 (0.68) PIK3CAMTORPIK3CGMAPK1CHEK1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4444289-A1 PYRIDOPYRIMIDINES AND METHODS OF THEIR USE Kineta, Inc. (US) 2024-10-16 EP disclosed
WO-2023107592-A1 PYRIDOPYRIMIDINES AND METHODS OF THEIR USE Kineta, Inc. (US) 2023-06-15 WO disclosed