SCHEMBL8400854

SCHEMBL8400854

Nc1nc(CC(CO)OCP(=O)(O)O)nc2nc[nH]c12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 1/20 0.40
PDPK1 O15530 1/20 0.40
GDA Q9Y2T3 1/20 0.40
SLC22A6 Q4U2R8 1/20 0.39
HPRT1 P00492 1/20 0.36
TYMP P19971 1/20 0.34
KDR P35968 1/20 0.34
AURKB Q96GD4 1/20 0.34
MGMT P16455 3/20 0.34
CDK1 P06493 4/20 0.33
CCNB1 P14635 4/20 0.33
CCNA2 P20248 4/20 0.33
CDK2 P24941 4/20 0.33
CCNA1 P78396 4/20 0.33
DPP4 P27487 1/20 0.33
PNP P00491 1/20 0.32
LMNA P02545 1/20 0.32
DRD3 P35462 1/20 0.32
PI4KA P42356 1/20 0.32
XDH P47989 1/20 0.32

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
SCHEMBL30575052 1.00 FGFR1 (0.40) FGFR1PDPK1GDASLC22A6HPRT1
SCHEMBL886934 0.85 PDPK1 (0.40) PDPK1GDAHPRT1TYMPKDR
SCHEMBL16037330 0.85 PDPK1 (0.40) PDPK1GDAHPRT1TYMPKDR
SCHEMBL2250902 0.82 FGFR1 (0.40) FGFR1SLC22A6HPRT1TYMP
Hypophosphorous Acid SCHEMBL3803586 0.81 PDPK1 (0.37) PDPK1GDAHPRT1KDRAURKB
SCHEMBL4241363 0.80 PDPK1 (0.42) FGFR1PDPK1GDAKDRAURKB
SCHEMBL4241351 0.78 PDPK1 (0.42) PDPK1GDAKDRAURKBMGMT
SCHEMBL29708075 0.76 PDPK1 (0.43) FGFR1PDPK1GDASLC22A6HPRT1
SCHEMBL3837871 0.76 PDPK1 (0.43) FGFR1PDPK1GDASLC22A6HPRT1
SCHEMBL16620498 0.75 PDPK1 (0.50) PDPK1GDAKDRAURKBMGMT

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
CN-116808067-A Application of lambda-carrageenan in resisting African swine fever virus infection 上海兆维医药科技有限公司 2023-09-29 CN disclosed
US-5874577-A Method for the preparing 9-12-(Diethoxyphosphonomethoxy)ethyl!adenine and analogues thereof MEDICHEM RESEARCH, INC. (US) 1999-02-23 US disclosed