SCHEMBL31367061

SCHEMBL31367061

Nc1ncnc2[nH]nc(-c3ccc4cn[nH]c4c3)c12

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 5/20 0.58
SRC P12931 5/20 0.58
KDR P35968 5/20 0.58
PIK3CD O00329 5/20 0.58
PIK3CA P42336 5/20 0.58
PIK3CB P42338 5/20 0.58
PIK3CG P48736 5/20 0.58
PRKDC P78527 5/20 0.58
EGFR P00533 4/20 0.58
HCK P08631 4/20 0.58
MTOR P42345 4/20 0.58
EPHB4 P54760 4/20 0.58
FGFR1 P11362 7/20 0.46
KDM4E B2RXH2 1/20 0.45
MEN1 O00255 1/20 0.45
MAPT P10636 1/20 0.45
PKM P14618 1/20 0.45
HTT P42858 1/20 0.45
KMT2A Q03164 1/20 0.45
LRRK2 Q5S007 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
SCHEMBL21467059 1.00 ABL1 (0.58) ABL1SRCKDRPIK3CDPIK3CA
SCHEMBL2237756 0.86 FGFR1 (0.50) ABL1SRCKDRPIK3CDPIK3CA
SCHEMBL12347206 0.83 PIK3CD (0.48) ABL1SRCKDRPIK3CDPIK3CA
SCHEMBL23917483 0.82 PIK3CD (0.60) ABL1SRCKDRPIK3CDPIK3CA
SCHEMBL3605078 0.80 PIK3CD (0.61) ABL1SRCKDRPIK3CDPIK3CA
SCHEMBL20748491 0.77 PIK3CG (0.54) ABL1SRCKDRPIK3CDPIK3CA
SCHEMBL12162 0.77 PIK3CD (0.74) ABL1SRCKDRPIK3CDPIK3CA
SCHEMBL19414290 0.75 SRC (0.57) ABL1SRCKDRPIK3CDPIK3CA
SCHEMBL17970655 0.75 KDR (0.51) ABL1SRCKDRPIK3CDPIK3CA
SCHEMBL30387175 0.75 PIK3CD (0.55) ABL1SRCKDRPIK3CDPIK3CA

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