SCHEMBL97295

SCHEMBL97295

C[C@H](Cn1cnc2c(=O)[nH]c(N)nc21)OCP(C)(=O)O

nearest known ligand 0.64

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HPRT1 P00492 17/20 0.64
MEN1 O00255 1/20 0.55
ALDH1A1 P00352 1/20 0.55
LMNA P02545 1/20 0.55
CYP3A4 P08684 1/20 0.55
NFKB1 P19838 1/20 0.55
BLM P54132 1/20 0.55
VCP P55072 1/20 0.55
KMT2A Q03164 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
HIF1A Q16665 1/20 0.55
POLB P06746 1/20 0.54

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
SCHEMBL172846 0.93 HPRT1 (0.70) HPRT1CYP3A4
SCHEMBL4713142 0.93 HPRT1 (0.70) HPRT1CYP3A4
SCHEMBL4715034 0.93 HPRT1 (0.70) HPRT1CYP3A4
SCHEMBL17194157 0.92 HPRT1 (0.64) HPRT1MEN1ALDH1A1LMNACYP3A4
Pyrophosphoric Acid SCHEMBL15053837 0.89 HPRT1 (0.66) HPRT1CYP3A4POLB
Pyrophosphoric Acid SCHEMBL15054252 0.89 HPRT1 (0.66) HPRT1CYP3A4POLB
Pyrophosphoric Acid SCHEMBL15054286 0.89 HPRT1 (0.66) HPRT1CYP3A4POLB
SCHEMBL15078235 0.88 CYP3A4 (0.53) HPRT1CYP3A4
SCHEMBL97316 0.88 HPRT1 (0.75) HPRT1MEN1ALDH1A1LMNACYP3A4
SCHEMBL15078152 0.87 POLB (0.68) 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150141375-A1 Methods of Treating Viral Associated Diseases CHIMERIX, INC. 2015-05-21 US disclosed
WO-2013095684-A1 GUANINE ANALOGS AS TELOMERASE SUBSTRATES AND TELOMERE LENGTH AFFECTORS GERON CORPORATION (US) 2013-06-27 WO disclosed
US-20130072458-A1 Methods of Treating Viral Associated Diseases CHIMERIX, INC. (US) 2013-03-21 US disclosed
US-20120058975-A1 Phosphonate Compounds THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2012-03-08 US disclosed
US-8008308-B2 Phosphonate compounds THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2011-08-30 US disclosed
WO-2011011710-A1 METHODS OF TREATING VIRAL INFECTIONS CHIMERIX, INC. (US) 2011-01-27 WO 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 (3 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-20130072458-A1 Methods of Treating Viral Associated Diseases HAVCR2, EIF2AK2, TSLP HPRT1 411/4885MEN1 1968/4885ALDH1A1 1045/4885
US-20120058975-A1 Phosphonate Compounds PHPT1, PHOSPHO1, PIK3CA HPRT1 130/4885MEN1 464/4885ALDH1A1 3840/4885
US-20150141375-A1 Methods of Treating Viral Associated Diseases HAVCR2, EIF2AK2, TSLP HPRT1 411/4885MEN1 1968/4885ALDH1A1 1045/4885

“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.