SCHEMBL8039258

SCHEMBL8039258

O=c1[nH]c(N(O)O)nc2nc(-c3ccccc3)[nH]c12

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 2/20 0.62
FGFR2 P21802 2/20 0.62
XDH P47989 5/20 0.59
ADORA2B P29275 2/20 0.50
ADORA2A P29274 2/20 0.47
ADORA3 P0DMS8 1/20 0.47
ADORA1 P30542 1/20 0.47
PNP P00491 1/20 0.46
TNKS O95271 1/20 0.43
PARP1 P09874 1/20 0.43
TNKS2 Q9H2K2 1/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
RNASEH1 O60930 1/20 0.42
ERCC1 P07992 1/20 0.42
FEN1 P39748 1/20 0.42
ERCC4 Q92889 1/20 0.42
PI4KA P42356 1/20 0.42
PI4K2B Q8TCG2 1/20 0.42
PI4K2A Q9BTU6 1/20 0.42

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
SCHEMBL21402773 0.84 FGFR1 (0.61) FGFR1FGFR2XDHADORA2BADORA2A
SCHEMBL1286943 0.77 FGFR1 (1.00) FGFR1FGFR2XDHADORA2BPNP
SCHEMBL1286927 0.72 FGFR1 (0.66) FGFR1FGFR2XDHADORA2BADORA2A
SCHEMBL3757546 0.71 FGFR1 (0.59) FGFR1FGFR2XDHADORA2BADORA2A
SCHEMBL8039267 0.71 FGFR1 (0.38) FGFR1FGFR2XDHADORA2BPNP
SCHEMBL7688477 0.68 GRIA1 (0.75) FGFR1FGFR2XDHADORA2BADORA2A
SCHEMBL378879 0.67 ADORA2B (1.00) FGFR1FGFR2XDHADORA2BADORA2A
SCHEMBL6889649 0.66 ADORA2B (0.69) XDHADORA2BADORA2AADORA3ADORA1
SCHEMBL14716577 0.65 FGFR1 (0.56) FGFR1FGFR2XDH
SCHEMBL7058942 0.65 ADORA2B (0.56) FGFR1FGFR2XDHADORA2BADORA2A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6051385-A A NUCLEIC ACID SEQUENCES THAT ENCODES A PROTEIN B5T74 THAT CONFERS THE ABILITY OF HERPES SIMPLEX VIRUS TO INFECT AND REPLICATE IN NON-PERMISSIVE CELLS; SCREENING VIRICIDES THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2000-04-18 US disclosed
WO-1999020761-A2 COMPOSITIONS AND METHODS FOR IDENTIFYING AND TESTING THERAPEUTICS AGAINST HSV INFECTION THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 1999-04-29 WO disclosed