SCHEMBL12702718

SCHEMBL12702718

CCC1OC(n2ccc(N)nc2=O)C(OC(=O)c2ccccc2)C1(C)CC

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.41
▸ THRB P10828 1/20 0.41
▸ MTOR P42345 1/20 0.41
▸ MDM2 Q00987 1/20 0.41
▸ NCOA1 Q15788 1/20 0.41
▸ NCOA3 Q9Y6Q9 1/20 0.41
▸ ST6GAL1 P15907 3/20 0.39
▸ PDE3A Q14432 3/20 0.37
▸ PDE4D Q08499 1/20 0.37
▸ SLC29A1 Q99808 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ POLB P06746 1/20 0.36
▸ POLA1 P09884 1/20 0.36
▸ CACNA1F O60840 2/20 0.35
▸ ALB P02768 2/20 0.35
▸ MAPT P10636 2/20 0.35
▸ CACNA1D Q01668 2/20 0.35
▸ CACNA1S Q13698 2/20 0.35
▸ CACNA1C Q13936 2/20 0.35

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
SCHEMBL12702728 0.85 DCK (0.39) LMNAPOLBALB
SCHEMBL16131588 0.85 ST6GAL1 (0.40) LMNATHRBMTORMDM2NCOA1
SCHEMBL12702742 0.78 NT5E (0.42) LMNASLC29A1MAPT
SCHEMBL7165495 0.77 ST6GAL1 (0.37) LMNATHRBMTORMDM2NCOA1
SCHEMBL7166943 0.76 NT5E (0.38) LMNATHRBMTORMDM2NCOA1
SCHEMBL10017438 0.76 PDE3A (0.56) LMNATHRBMTORMDM2NCOA1
SCHEMBL12702721 0.76 TSHR (0.32) LMNAPOLBMAPT
SCHEMBL7158886 0.76 ST6GAL1 (0.40) LMNATHRBMTORMDM2NCOA1
SCHEMBL7157425 0.76 NT5E (0.40) LMNATHRBMTORMDM2NCOA1
SCHEMBL12702778 0.75 LMNA (0.45) LMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8846636-B2 Nucleoside analogues with quaternary carbon stereogenic centers and methods of use LCB PHARMA INC. (CA) 2014-09-30 — — US disclosed
US-20110092451-A1 NUCLEOTIDE ANALOGUES WITH QUATERNARY CARBON STEREOGENIC CENTERS AND METHODS OF USE INSTITUT DE RECHERCHES CLINIQUES DE MONTREAL (CA) 2011-04-21 — — 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-20110092451-A1 NUCLEOTIDE ANALOGUES WITH QUATERNARY CARBON STEREOGENIC CENTERS AND METHODS OF USE NUDT1, NT5C3B, NTPCR LMNA 1770/4885THRB 4121/4885MTOR 624/4885

“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.

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