SCHEMBL5767283

SCHEMBL5767283

NC(=O)Cc1cnc2cc(Cl)ccn12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 5/20 0.48
FGFR3 P22607 4/20 0.48
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
PRMT5 O14744 1/20 0.39
WDR77 Q9BQA1 1/20 0.39
SIRT1 Q96EB6 2/20 0.38
HPGD P15428 2/20 0.36
GGPS1 O95749 1/20 0.35
FDPS P14324 1/20 0.35
GPR139 Q6DWJ6 2/20 0.35
KDM4E B2RXH2 2/20 0.34
ALDH1A1 P00352 2/20 0.34
GAA P10253 2/20 0.34
PKM P14618 1/20 0.34
FLT3 P36888 1/20 0.34
PDE4A P27815 1/20 0.34
PDE4B Q07343 1/20 0.34
PDE4C Q08493 1/20 0.34
PDE4D Q08499 1/20 0.34

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
SCHEMBL2260984 0.82 KDM4E (0.52) NPC1RAB9APRMT5WDR77HPGD
SCHEMBL24349175 0.80 PRMT5 (0.45) KDRFGFR3NPC1RAB9APRMT5
SCHEMBL2265948 0.79 PRMT5 (0.42) NPC1RAB9APRMT5WDR77HPGD
SCHEMBL2267420 0.79 PRMT5 (0.43) KDRFGFR3PRMT5WDR77GGPS1
SCHEMBL2260901 0.78 POLB (0.56) NPC1RAB9APRMT5WDR77ALDH1A1
SCHEMBL633944 0.77 GGPS1 (0.57) NPC1RAB9AHPGDGGPS1FDPS
SCHEMBL14748149 0.76 KDR (0.43) KDRFGFR3NPC1RAB9APRMT5
SCHEMBL21577725 0.76 KDM4E (0.35) GGPS1FDPSKDM4EGLA
SCHEMBL21941682 0.76 USP7 (0.34) KDRGGPS1FDPSKDM4EALDH1A1
SCHEMBL23651853 0.75 SMN1; SMN2 (0.37) KDM4EGLA

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-1483265-B1 PURINE DERIVATIVES AS KINASE INHIBITORS LILLY CO ELI (US) 2006-11-22 EP disclosed