SCHEMBL2906000

SCHEMBL2906000

CC(C)C1(C(C)C)CC1(Cn1cnc2c(N)ncnc21)OOP(C)(=O)O

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 9/20 0.50
ADORA2A P29274 4/20 0.46
ADORA1 P30542 3/20 0.46
FGFR1 P11362 1/20 0.45
SLC22A6 Q4U2R8 1/20 0.45
CYP2D6 P10635 7/20 0.44
ADORA2B P29275 1/20 0.43
PI4KA P42356 1/20 0.42
PI4K2B Q8TCG2 1/20 0.42
PI4K2A Q9BTU6 1/20 0.42
PI4KB Q9UBF8 1/20 0.42
ENPP1 P22413 1/20 0.42
METTL3 Q86U44 1/20 0.41
METTL14 Q9HCE5 1/20 0.41
ALDH1A1 P00352 1/20 0.41

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
SCHEMBL2911275 0.82 CYP3A4 (0.43) CYP3A4ADORA2AADORA1FGFR1SLC22A6
SCHEMBL4279921 0.79 CYP3A4 (0.47) CYP3A4ADORA2AADORA1FGFR1SLC22A6
SCHEMBL4558842 0.75 CYP3A4 (0.70) CYP3A4ADORA2AADORA1CYP2D6ALDH1A1
SCHEMBL8395927 0.75 CYP3A4 (0.70) CYP3A4ADORA2AADORA1CYP2D6ALDH1A1
SCHEMBL2913580 0.74 CYP3A4 (0.50) CYP3A4ADORA2AADORA1FGFR1SLC22A6
SCHEMBL3290251 0.74 FGFR1 (0.60) CYP3A4ADORA2AADORA1FGFR1SLC22A6
SCHEMBL28797058 0.72 SLC22A6 (0.67) CYP3A4ADORA2AADORA1FGFR1SLC22A6
SCHEMBL4265441 0.72 POLB (0.36)
SCHEMBL13328650 0.71 CYP3A4 (0.48) CYP3A4ADORA2AADORA1FGFR1SLC22A6
SCHEMBL2911598 0.71 CYP3A4 (0.55) CYP3A4ADORA2AADORA1FGFR1SLC22A6

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-1358198-B1 NOVEL ACYCLIC NUCLEOSIDE PHOSPHONATE DERIVATIVES, SALTS THEREOF AND PROCESS FOR THE PREPARATION OF THE SAME LG LIFE SCIENCES LTD (KR) 2010-08-25 EP disclosed
US-7605147-B2 Acyclic nucleoside phosphonate derivatives, salts thereof and process for the preparation of the same LG LIFE SCIENCES LTD. (KR) 2009-10-20 US disclosed
US-20060293284-A1 Novel acyclic nucleoside phosphonate derivatives, salts thereof and process for the preparation of the same CHO DONG-GYU 2006-12-28 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060293284-A1 Novel acyclic nucleoside phosphonate derivatives, salts thereof and process for the preparation of the same PNP, ITPA, MTAP CYP3A4 456/4885ADORA2A 119/4885ADORA1 174/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.