SCHEMBL25626203

SCHEMBL25626203

CCc1c(OCc2cccnc2)nc(N2CCOCC2)nc1N(C=O)c1cccc(C)c1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ PRKDC P78527 6/20 0.41
▸ RAD52 P43351 1/20 0.41
▸ PIK3CA P42336 3/20 0.40
▸ PIK3CD O00329 3/20 0.40
▸ PIK3CB P42338 2/20 0.40
▸ PIK3CG P48736 2/20 0.40
▸ P2RY12 Q9H244 1/20 0.40
▸ MAPK14 Q16539 1/20 0.36
▸ TP53 P04637 1/20 0.36
▸ POLB P06746 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ CTSL P07711 1/20 0.35
▸ HRH4 Q9H3N8 1/20 0.35
▸ GBA1 P04062 1/20 0.35
▸ FGFR1 P11362 1/20 0.35
▸ KDR P35968 1/20 0.35
▸ EPHB4 P54760 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
SCHEMBL30353531 0.71 PRKDC (0.44) PRKDCRAD52PIK3CAPIK3CDPIK3CB
SCHEMBL25618870 0.71 PRKDC (0.44) PRKDCRAD52PIK3CAPIK3CDPIK3CB
SCHEMBL30353540 0.71 PRKDC (0.44) PRKDCRAD52PIK3CAPIK3CDPIK3CB
SCHEMBL30353557 0.70 RAD52 (0.44) PRKDCRAD52PIK3CAPIK3CDPIK3CB
SCHEMBL25626207 0.70 RAD52 (0.44) PRKDCRAD52PIK3CAPIK3CDPIK3CB
SCHEMBL4121103 0.67 PIK3CA (0.53) PRKDCRAD52PIK3CAPIK3CDPIK3CB
SCHEMBL30353552 0.64 PIK3CD (0.44) PRKDCRAD52PIK3CAPIK3CDPIK3CB
SCHEMBL25626249 0.64 PIK3CD (0.44) PRKDCRAD52PIK3CAPIK3CDPIK3CB
SCHEMBL31547941 0.64 PIK3CA (0.63) PRKDCPIK3CA
SCHEMBL25617735 0.64 PIK3CA (0.63) PRKDCPIK3CA

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-2023107623-A2 BICYCLIC HETEROARENES AND METHODS OF THEIR USE Kineta, Inc. (US) 2023-06-15 — — WO disclosed
Send feedback