SCHEMBL29314644

SCHEMBL29314644

CCP(=O)(O)Cc1ccc(-c2cnc(N)c(NCc3ccc4ncccc4c3)n2)cc1

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LDHA P00338 1/20 0.43
LDHB P07195 1/20 0.43
MET P08581 6/20 0.42
SYK P43405 4/20 0.42
HDAC6 Q9UBN7 1/20 0.41
KLKB1 P03952 1/20 0.39
KLK1 P06870 1/20 0.39
ATR Q13535 1/20 0.38
KDR P35968 3/20 0.38
NPC1 O15118 1/20 0.38
PDPK1 O15530 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
SCHEMBL29314116 0.86 MET (0.41) LDHALDHBMETSYKHDAC6
SCHEMBL22109393 0.81 SYK (0.46) LDHALDHBMETSYKATR
SCHEMBL29315639 0.79 LDHA (0.44) LDHALDHBMETSYKATR
SCHEMBL29314985 0.77 MET (0.40) LDHALDHBMETSYKHDAC6
SCHEMBL29314805 0.76 LDHB (0.48) LDHALDHBMETATRPDPK1
SCHEMBL22109397 0.76 LDHA (0.48) LDHALDHBMETSYKATR
SCHEMBL29318098 0.76 LDHA (0.42) LDHALDHBMETSYKATR
SCHEMBL1163132 0.74 NPC1 (0.53) METSYKHDAC6KLKB1KLK1
SCHEMBL22109324 0.74 MET (0.70) MET
SCHEMBL29314182 0.73 CSF1R (0.45) LDHALDHBMET

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