SCHEMBL15045870

SCHEMBL15045870

COC[C@H]1O[C@@H](n2ccc(N)nc2=O)[C@](C)(F)[C@@H]1O

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE3A Q14432 3/20 0.60
PDE4D Q08499 1/20 0.60
SLC29A1 Q99808 1/20 0.60
POLA1 P09884 2/20 0.56
LMNA P02545 3/20 0.46
THRB P10828 1/20 0.46
MTOR P42345 1/20 0.46
MDM2 Q00987 1/20 0.46
NCOA1 Q15788 1/20 0.46
NCOA3 Q9Y6Q9 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.41
POLB P06746 1/20 0.41
TSHR P16473 1/20 0.40
GLA P06280 1/20 0.40
CACNA1F O60840 2/20 0.40
ALB P02768 2/20 0.40
MAPT P10636 2/20 0.40
CACNA1D Q01668 2/20 0.40
CACNA1S Q13698 2/20 0.40
CACNA1C Q13936 2/20 0.40

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
SCHEMBL21558070 1.00 PDE3A (0.60) PDE3APDE4DSLC29A1POLA1LMNA
SCHEMBL19758224 0.90 PDE3A (0.75) PDE3APDE4DSLC29A1POLA1LMNA
SCHEMBL382458 0.90 PDE3A (0.75) PDE3APDE4DSLC29A1POLA1LMNA
SCHEMBL15788426 0.90 PDE3A (0.75) PDE3APDE4DSLC29A1POLA1LMNA
SCHEMBL15257778 0.88 PDE4D (0.57) PDE3APDE4DSLC29A1POLA1LMNA
SCHEMBL16130399 0.88 PDE3A (0.54) PDE3APDE4DSLC29A1POLA1LMNA
SCHEMBL16556325 0.88 PDE3A (0.54) PDE3APDE4DSLC29A1POLA1LMNA
SCHEMBL15045901 0.88 PDE3A (0.56) PDE3APDE4DSLC29A1POLA1LMNA
SCHEMBL1200110 0.87 PDE3A (0.78) PDE3APDE4DSLC29A1POLA1LMNA
SCHEMBL20991003 0.87 PDE3A (0.78) PDE3APDE4DSLC29A1POLA1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9624249-B2 Nucleoside kinase bypass compositions and methods MERCK SHARP & DOHME CORP. (US) 2017-04-18 US disclosed
US-20160129122-A1 FATTY ACID ANTIVIRAL CONJUGATES AND THEIR USES CATABASIS PHARMACEUTICALS, INC. 2016-05-12 US disclosed
US-20150315221-A1 NUCLEOSIDE KINASE BYPASS COMPOSITIONS AND METHODS MERCK SHARP & DOHME CORP. (US) 2015-11-05 US disclosed
US-20140288025-A1 FATTY ACID ANTIVIRAL CONJUGATES AND THEIR USES CATABASIS PHARMACEUTICALS, INC. (US) 2014-09-25 US disclosed
WO-2014088923-A1 NUCLEOSIDE KINASE BYPASS COMPOSITIONS AND METHODS MERCK SHARP & DOHME CORP. (US) 2014-06-12 WO disclosed
US-20130244966-A1 FATTY ACID ANTIVIRAL CONJUGATES AND THEIR USES CATABASIS PHARMACEUTICALS, INC. (US) 2013-09-19 US disclosed
WO-2013090420-A2 FATTY ACID ANTIVIRAL CONJUGATES AND THEIR USES CATABASIS PHARMACEUTICALS, INC. (US) 2013-06-20 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 (4 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-20130244966-A1 FATTY ACID ANTIVIRAL CONJUGATES AND THEIR USES FABP1, FABP2, HAVCR2 PDE3A 3539/4885PDE4D 3319/4885SLC29A1 358/4885
US-20140288025-A1 FATTY ACID ANTIVIRAL CONJUGATES AND THEIR USES FABP1, FABP2, HAVCR2 PDE3A 3539/4885PDE4D 3319/4885SLC29A1 358/4885
US-20150315221-A1 NUCLEOSIDE KINASE BYPASS COMPOSITIONS AND METHODS DCK, DTYMK, TK1 PDE3A 810/4885PDE4D 910/4885SLC29A1 361/4885
US-20160129122-A1 FATTY ACID ANTIVIRAL CONJUGATES AND THEIR USES FABP1, FABP2, HAVCR2 PDE3A 3539/4885PDE4D 3319/4885SLC29A1 358/4885

“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.