SCHEMBL9675832

SCHEMBL9675832

Nc1nc2c(ncn2OCC(CO)SCP(=O)(O)O)c(=O)[nH]1

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HPRT1 P00492 15/20 0.52
MEN1 O00255 1/20 0.47
ALDH1A1 P00352 1/20 0.47
LMNA P02545 1/20 0.47
CYP3A4 P08684 1/20 0.47
NFKB1 P19838 1/20 0.47
BLM P54132 1/20 0.47
VCP P55072 1/20 0.47
KMT2A Q03164 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
HIF1A Q16665 1/20 0.47
PNP P00491 5/20 0.46

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
SCHEMBL10448323 1.00 HPRT1 (0.52) HPRT1MEN1ALDH1A1LMNACYP3A4
SCHEMBL10448313 1.00 HPRT1 (0.52) HPRT1MEN1ALDH1A1LMNACYP3A4
SCHEMBL9677354 0.88 PNP (0.44) HPRT1MEN1ALDH1A1LMNACYP3A4
SCHEMBL9684414 0.83 HPRT1 (0.56) HPRT1PNP
SCHEMBL9555507 0.81 HPRT1 (0.58) HPRT1MEN1ALDH1A1LMNACYP3A4
SCHEMBL9417201 0.81 HPRT1 (0.58) HPRT1MEN1ALDH1A1LMNACYP3A4
SCHEMBL9555352 0.81 HPRT1 (0.58) HPRT1MEN1ALDH1A1LMNACYP3A4
SCHEMBL8834028 0.81 BLM (0.57) HPRT1MEN1ALDH1A1LMNACYP3A4
SCHEMBL9685349 0.80 HPRT1 (0.59) HPRT1PNP
SCHEMBL9185750 0.80 BLM (0.56) HPRT1MEN1ALDH1A1LMNACYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0399743-A1 Phosphonomethylthio-alkoseypureine derivatives, intermediate products for their preparation and pharmaceutical compositions containing them BEECHAM GROUP PLC (GB) 1990-11-28 EP claimed
US-5108994-A Synergistic with interferon; herpes virus BEECHAM GROUP P.L.C. (GB) 1992-04-28 US disclosed
EP-0399743-A1 Phosphonomethylthio-alkoseypureine derivatives, intermediate products for their preparation and pharmaceutical compositions containing them BEECHAM GROUP PLC (GB) 1990-11-28 EP disclosed