SCHEMBL9858347

SCHEMBL9858347

Nc1nc(N)c2ncn(OC(O)CCOCP(=O)(O)O)c2n1

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 1/20 0.47
SLC22A6 Q4U2R8 1/20 0.47
HPRT1 P00492 4/20 0.41
NT5E P21589 1/20 0.41
CYP3A4 P08684 1/20 0.38
CDK1 P06493 2/20 0.37
CCNB1 P14635 2/20 0.37
CCNE1 P24864 2/20 0.37
CDK2 P24941 2/20 0.37
ENPP1 P22413 1/20 0.36
POLB P06746 2/20 0.36
AHCY P23526 1/20 0.34
PNP P00491 1/20 0.34

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
SCHEMBL9857628 0.86 FGFR1 (0.61) FGFR1SLC22A6CYP3A4ENPP1
SCHEMBL9417176 0.83 FGFR1 (0.51) FGFR1SLC22A6HPRT1NT5ECYP3A4
SCHEMBL9858115 0.82 HPRT1 (0.63) HPRT1POLBPNP
SCHEMBL9858340 0.81 HPRT1 (0.43) FGFR1SLC22A6HPRT1NT5ECYP3A4
SCHEMBL9858167 0.81 FGFR1 (0.49) FGFR1SLC22A6HPRT1NT5ECYP3A4
SCHEMBL9858162 0.80 FGFR1 (0.59) FGFR1SLC22A6CYP3A4ENPP1
Pmedap SCHEMBL29571667 0.77 FGFR1 (0.72) FGFR1SLC22A6HPRT1CYP3A4CDK1
Pmedap SCHEMBL215611 0.77 FGFR1 (0.72) FGFR1SLC22A6HPRT1CYP3A4CDK1
SCHEMBL9858344 0.76 HPRT1 (0.58) HPRT1POLBPNP
SCHEMBL9858153 0.74 FGFR1 (0.60) FGFR1SLC22A6CYP3A4ENPP1AHCY

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5055458-A PURINE DERIVATIVES HAVING ANTIVIRAL ACTIVITY BEECHAM GROUP P.L.C. (GB) 1991-10-08 US claimed
EP-0353955-A2 Novel compounds BEECHAM GROUP PLC (GB) 1990-02-07 EP claimed
US-5055458-A PURINE DERIVATIVES HAVING ANTIVIRAL ACTIVITY BEECHAM GROUP P.L.C. (GB) 1991-10-08 US disclosed
EP-0353955-A2 Novel compounds BEECHAM GROUP PLC (GB) 1990-02-07 EP disclosed