SCHEMBL9412751

SCHEMBL9412751

O=C(CCl)Nn1cnc2c(Cl)ncnc21

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 9/20 0.55
FGFR4 P22455 9/20 0.55
HDAC6 Q9UBN7 3/20 0.45
P2RX7 Q99572 2/20 0.45
FDPS P14324 1/20 0.44
GSK3B P49841 1/20 0.40
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
HTT P42858 1/20 0.36
DGAT1 O75907 1/20 0.35
ADCY5 O95622 2/20 0.33

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
SCHEMBL9412574 0.85 FGFR1 (0.41) FGFR1FGFR4HDAC6P2RX7GSK3B
SCHEMBL22326706 0.73 FDPS (0.41) FGFR1FGFR4HDAC6P2RX7FDPS
SCHEMBL8906057 0.72 FDPS (0.41) FGFR1FGFR4HDAC6P2RX7FDPS
SCHEMBL8503725 0.68 FGFR1 (0.43) FGFR1FGFR4HDAC6P2RX7FDPS
SCHEMBL23885424 0.68 P2RX7 (0.66) FGFR1FGFR4HDAC6P2RX7FDPS
SCHEMBL3273477 0.67 GSK3B (0.49) FGFR1FGFR4HDAC6P2RX7FDPS
SCHEMBL21591519 0.67 FGFR1 (0.51) FGFR1FGFR4HDAC6P2RX7FDPS
SCHEMBL9412748 0.67 FGFR1 (0.48) FGFR1FGFR4HDAC6P2RX7FDPS
SCHEMBL30449152 0.67 GSK3B (0.52) FGFR1FGFR4HDAC6P2RX7FDPS
SCHEMBL28020916 0.67 P2RX7 (0.64) FGFR1FGFR4HDAC6P2RX7FDPS

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-0590361-A1 Process for the preparation of 2-amino-6-halopurines BASF Aktiengesellschaft (DE) 1994-04-06 EP disclosed