SCHEMBL29315331

SCHEMBL29315331

CC(C)OP(C)c1ccc(-c2cnc(N)c(NC(C)c3ccc4ncccc4c3)n2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LDHB P07195 12/20 0.45
LDHA P00338 12/20 0.45
MET P08581 5/20 0.37
ATR Q13535 1/20 0.37
PIK3CD O00329 1/20 0.35
ABL1 P00519 1/20 0.35
EGFR P00533 1/20 0.35
HCK P08631 1/20 0.35
SRC P12931 1/20 0.35
KDR P35968 1/20 0.35
PIK3CA P42336 1/20 0.35
PIK3CB P42338 1/20 0.35
MTOR P42345 1/20 0.35
PIK3CG P48736 1/20 0.35
EPHB4 P54760 1/20 0.35
BACE1 P56817 1/20 0.35
PRKDC P78527 1/20 0.35
PI4KB Q9UBF8 1/20 0.35
PDE4C Q08493 1/20 0.35
PDE4D Q08499 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
SCHEMBL29314832 0.82 LDHA (0.50) LDHBLDHAMETATR
SCHEMBL29869599 0.78 MET (0.46) LDHBLDHAMET
SCHEMBL12165466 0.78 MET (0.46) LDHBLDHAMET
SCHEMBL29314805 0.77 LDHB (0.48) LDHBLDHAMETATR
SCHEMBL14378623 0.75 MET (0.45) LDHBLDHAMET
SCHEMBL22109200 0.71 ATR (0.39) METATRPIK3CDABL1EGFR
SCHEMBL22109393 0.71 SYK (0.46) LDHBLDHAMETATR
SCHEMBL1329664 0.70 MET (0.50) MET
SCHEMBL1330016 0.67 MET (0.45) MET
SCHEMBL19672758 0.64 ATR (0.60) ATRPRKDC

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-3893872-B1 ORGANOPHOSPHORUS-SUBSTITUTED COMPOUNDS AS C-MET INHIBITORS AND THERAPEUTIC USES THEREOF BETA PHARMA INC (US) 2024-07-17 EP disclosed