SCHEMBL30677309

SCHEMBL30677309

c1cc2cnc(N3CCOCC3)[nH]c-2n1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 6/20 0.43
PIK3CD O00329 3/20 0.43
PIK3R1 P27986 3/20 0.43
PIK3CB P42338 2/20 0.43
TP53 P04637 1/20 0.42
MEN1 O00255 1/20 0.41
TSHR P16473 1/20 0.41
KMT2A Q03164 1/20 0.41
HSD17B10 Q99714 1/20 0.41
LRRK2 Q5S007 2/20 0.39
MTOR P42345 3/20 0.38
CNR2 P34972 3/20 0.38
MAPK10 P53779 2/20 0.38
POLB P06746 1/20 0.38
AR P10275 1/20 0.37

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
SCHEMBL30677461 0.76 PIK3CA (0.41) PIK3CAPIK3CDPIK3R1PIK3CBTP53
SCHEMBL497431 0.73 DCTPP1 (0.48) PIK3CAPIK3CDPIK3CBTP53MEN1
SCHEMBL14334321 0.69 KMT2A (0.42) PIK3CAPIK3CDPIK3CBTP53MEN1
SCHEMBL21325364 0.69 CNR1 (0.43) PIK3CAPIK3R1TP53MEN1TSHR
SCHEMBL15893927 0.69 CYP2C19 (0.43) PIK3CAPIK3CBTP53MEN1TSHR
SCHEMBL4035898 0.69 TSHR (0.42) PIK3CAPIK3CDPIK3R1PIK3CBTP53
SCHEMBL30766045 0.68 KMT2A (0.51) PIK3CATP53MEN1TSHRKMT2A
SCHEMBL9760977 0.67 POLB (0.52) TP53MEN1TSHRKMT2AHSD17B10
SCHEMBL15733180 0.67 HTT (0.47) PIK3CATP53MEN1TSHRKMT2A
SCHEMBL14334236 0.67 KMT2A (0.43) TP53MEN1TSHRKMT2AHSD17B10

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-2024014885-A1 NOVEL BICYCLIC HETEROARYL COMPOUND AND USE THEREOF 일동제약(주) 2024-01-18 WO disclosed