SCHEMBL9275474

SCHEMBL9275474

CCONc1nc2nc(C)[nH]c2c(=O)[nH]1

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
XDH P47989 3/20 0.38
GDA Q9Y2T3 1/20 0.35
FGFR1 P11362 3/20 0.34
FGFR2 P21802 3/20 0.34
PNP P00491 3/20 0.34
NUDT1 P36639 1/20 0.33
FGFR3 P22607 1/20 0.33
POLA1 P09884 1/20 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
SCHEMBL5133744 0.88 XDH (0.39) XDHGDAFGFR1FGFR2PNP
SCHEMBL2113438 0.84 GDA (0.35) XDHGDAFGFR1FGFR2PNP
SCHEMBL27775482 0.79 XDH (0.61) XDHGDAPOLA1
SCHEMBL3512356 0.77 GDA (0.35) XDHGDAFGFR1FGFR2PNP
SCHEMBL65614 0.77 GDA (0.40) XDHGDAFGFR1FGFR2PNP
SCHEMBL26155922 0.74 PNP (0.48) PNPNUDT1
SCHEMBL4384740 0.74 XDH (0.67) XDHPNPPOLA1
SCHEMBL8591402 0.73 FGFR1 (0.51) GDAFGFR1FGFR2PNPFGFR3
SCHEMBL16513137 0.72 GDA (0.64) GDAFGFR1FGFR2FGFR3
SCHEMBL6270959 0.72 FYN (0.52)

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
EP-0662819-A1 AN ANTIVIRALLY ACTIVE PHARMACEUTICAL OIL-IN-WATER EMULSION CONTAINING 9- (2-HYDROXYETHOXY)METHYL]GUANINE (ACYCLOVIR) OR A SALT OR ESTER THEREOF. GEA FARMACEUTISK FABRIK AS (DK) 1995-07-19 EP claimed
WO-1994005258-A1 AN ANTIVIRALLY ACTIVE PHARMACEUTICAL OIL-IN-WATER EMULSION CONTAINING 9-[(2-HYDROXYETHOXY)METHYL]GUANINE (ACYCLOVIR) OR A SALT OR ESTER THEREOF A/S GEA FARMACEUTISK FABRIK (DK) 1994-03-17 WO claimed