SCHEMBL29314832

SCHEMBL29314832

CC(Nc1nc(-c2cccc(P(C)C)c2)cnc1N)c1ccc2ncccc2c1

nearest known ligand 0.50

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
LDHA P00338 14/20 0.50
LDHB P07195 13/20 0.50
ATR Q13535 1/20 0.41
MET P08581 4/20 0.38

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
SCHEMBL29315331 0.82 LDHB (0.45) LDHALDHBATRMET
SCHEMBL22109397 0.81 LDHA (0.48) LDHALDHBATRMET
SCHEMBL29869599 0.78 MET (0.46) LDHALDHBMET
SCHEMBL12165466 0.78 MET (0.46) LDHALDHBMET
SCHEMBL14378623 0.77 MET (0.45) LDHALDHBMET
SCHEMBL29314805 0.75 LDHB (0.48) LDHALDHBATRMET
SCHEMBL29317374 0.72 MET (0.42) ATRMET
SCHEMBL22109200 0.71 ATR (0.39) ATRMET
SCHEMBL22109393 0.71 SYK (0.46) LDHALDHBATRMET
SCHEMBL1329664 0.70 MET (0.50) MET

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