SCHEMBL2912875

SCHEMBL2912875

CC(C)CC(=O)OCOP(=O)(COC1(Cn2cnc3c(N)ncnc32)CC1)OCOC(=O)CC(C)C

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FAP Q12884 3/20 0.54
SLC22A6 Q4U2R8 2/20 0.51
ABCB11 O95342 1/20 0.51
POLA1 P09884 1/20 0.51
POLG P54098 1/20 0.51
CYP3A4 P08684 9/20 0.46
METTL3 Q86U44 1/20 0.42
METTL14 Q9HCE5 1/20 0.42
ADORA2A P29274 1/20 0.41
ADORA1 P30542 1/20 0.41
FGFR1 P11362 1/20 0.41
CYP2D6 P10635 10/20 0.41
ALDH1A1 P00352 1/20 0.39

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
SCHEMBL2911836 0.87 FAP (0.69) FAPSLC22A6ABCB11POLA1POLG
SCHEMBL4265361 0.83 FAP (0.49) FAPSLC22A6ABCB11POLA1POLG
SCHEMBL2907772 0.82 KDM4E (0.43) FAPSLC22A6ABCB11POLA1POLG
SCHEMBL13328610 0.82 CYP3A4 (0.50) FAPSLC22A6ABCB11POLA1POLG
SCHEMBL2905475 0.82 FAP (0.62) FAPSLC22A6ABCB11POLA1POLG
SCHEMBL10050000 0.82 FAP (0.78) FAPSLC22A6ABCB11POLA1POLG
SCHEMBL2912968 0.80 FAP (0.62) FAPSLC22A6ABCB11POLA1POLG
SCHEMBL2911904 0.80 FAP (0.45) FAPSLC22A6ABCB11POLA1POLG
SCHEMBL2904496 0.79 FGFR1 (0.61) SLC22A6CYP3A4METTL3METTL14ADORA2A
SCHEMBL2908477 0.78 KDM4E (0.40) FAPSLC22A6ABCB11POLA1POLG

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 5 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 claimed
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 claimed
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 claimed
US-20060052346-A1 Nucleoside phosphonate derivatives useful in the treatment of HIV infections LG LIFE SCIENCES LTD. (KR) 2006-03-09 US claimed
US-20060052346-A1 Nucleoside phosphonate derivatives useful in the treatment of HIV infections LG LIFE SCIENCES LTD. (KR) 2006-03-09 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 (2 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-20060052346-A1 Nucleoside phosphonate derivatives useful in the treatment of HIV infections PNP, TYMP, ENTPD5 FAP 2508/4885SLC22A6 989/4885ABCB11 517/4885
US-20060293284-A1 Novel acyclic nucleoside phosphonate derivatives, salts thereof and process for the preparation of the same PNP, ITPA, MTAP FAP 2016/4885SLC22A6 1234/4885ABCB11 478/4885

“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.