SCHEMBL3873568

SCHEMBL3873568

COc1ccc(N2CCc3c(C(N)=O)nn(-c4cccc(Cl)c4)c3C2=O)cc1

nearest known ligand 0.69

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
F10 P00742 20/20 0.69
F2 P00734 3/20 0.69
SLC29A1 Q99808 1/20 0.69

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
SCHEMBL3886027 0.89 F10 (0.78) F10F2SLC29A1
SCHEMBL3879293 0.89 CCNA2 (0.56) F10F2SLC29A1
SCHEMBL16730323 0.88 F10 (0.74) F10F2SLC29A1
SCHEMBL3872417 0.87 CCNA2 (0.52) F10F2SLC29A1
SCHEMBL5314371 0.87 F10 (0.59) F10F2SLC29A1
SCHEMBL21504326 0.86 F10 (0.69) F10F2SLC29A1
SCHEMBL15174759 0.86 F10 (0.80) F10F2SLC29A1
SCHEMBL18058761 0.85 F10 (0.78) F10F2SLC29A1
SCHEMBL16730315 0.85 F10 (0.78) F10F2SLC29A1
SCHEMBL1996263 0.85 F10 (0.69) F10F2SLC29A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7579472-B2 Efficient synthesis of 4,5-dihydro-pyrazolo[3,4-c]pyrid-2-ones BRISTOL-MYERS SQUIBB COMPANY (US) 2009-08-25 US disclosed
US-7579472-B2 Efficient synthesis of 4,5-dihydro-pyrazolo[3,4-c]pyrid-2-ones BRISTOL-MYERS SQUIBB COMPANY (US) 2009-08-25 US disclosed
US-7579472-B2 Efficient synthesis of 4,5-dihydro-pyrazolo[3,4-c]pyrid-2-ones BRISTOL-MYERS SQUIBB COMPANY (US) 2009-08-25 US disclosed
US-7435821-B2 Efficient synthesis of 4,5-dihydro-pyrazolo[3,4-c]pyrid-2-ones BRISTOL-MYERS SQUIBB COMPANY (US) 2008-10-14 US disclosed
US-7435821-B2 Efficient synthesis of 4,5-dihydro-pyrazolo[3,4-c]pyrid-2-ones BRISTOL-MYERS SQUIBB COMPANY (US) 2008-10-14 US disclosed
US-7435821-B2 Efficient synthesis of 4,5-dihydro-pyrazolo[3,4-c]pyrid-2-ones BRISTOL-MYERS SQUIBB COMPANY (US) 2008-10-14 US disclosed
US-20080009626-A1 Reacting a 3-leaving group-1-(p-leaving group-phenyl)tetrahydro-2-pyridone with 2-hydroxypyridine and reacting the product with an alpha-oxoacetaldehyde phenylhydrazone to form 1-phenyl-3-carbonyl-6-(p-(2-pyridon-1-yl)phenyl-4,5-dihydro-pyrazolo[3,4-c]pyrid-2-one derivatives; bases; aprotic solvents MUDRYK BOGUSLAW M 2008-01-10 US disclosed
US-20080009626-A1 Reacting a 3-leaving group-1-(p-leaving group-phenyl)tetrahydro-2-pyridone with 2-hydroxypyridine and reacting the product with an alpha-oxoacetaldehyde phenylhydrazone to form 1-phenyl-3-carbonyl-6-(p-(2-pyridon-1-yl)phenyl-4,5-dihydro-pyrazolo[3,4-c]pyrid-2-one derivatives; bases; aprotic solvents MUDRYK BOGUSLAW M 2008-01-10 US disclosed
US-20080009626-A1 Reacting a 3-leaving group-1-(p-leaving group-phenyl)tetrahydro-2-pyridone with 2-hydroxypyridine and reacting the product with an alpha-oxoacetaldehyde phenylhydrazone to form 1-phenyl-3-carbonyl-6-(p-(2-pyridon-1-yl)phenyl-4,5-dihydro-pyrazolo[3,4-c]pyrid-2-one derivatives; bases; aprotic solvents MUDRYK BOGUSLAW M 2008-01-10 US disclosed
US-20070282106-A1 EFFICIENT SYNTHESIS OF 4,5-DIHYDRO-PYRAZOLO[3,4-c]PYRID-2-ONES MUDRYK BOGUSLAW M 2007-12-06 US disclosed
US-20070282106-A1 EFFICIENT SYNTHESIS OF 4,5-DIHYDRO-PYRAZOLO[3,4-c]PYRID-2-ONES MUDRYK BOGUSLAW M 2007-12-06 US disclosed
US-20070282106-A1 EFFICIENT SYNTHESIS OF 4,5-DIHYDRO-PYRAZOLO[3,4-c]PYRID-2-ONES MUDRYK BOGUSLAW M 2007-12-06 US disclosed
US-7304157-B2 Efficient synthesis of 4,5-dihydro-pyrazolo[3,4-c]pyrid-2-ones BRISTOL-MYERS SQUIBB COMPANY (US) 2007-12-04 US disclosed
US-7304157-B2 Efficient synthesis of 4,5-dihydro-pyrazolo[3,4-c]pyrid-2-ones BRISTOL-MYERS SQUIBB COMPANY (US) 2007-12-04 US disclosed
US-7304157-B2 Efficient synthesis of 4,5-dihydro-pyrazolo[3,4-c]pyrid-2-ones BRISTOL-MYERS SQUIBB COMPANY (US) 2007-12-04 US disclosed
EP-1805176-A2 EFFICIENT SYNTHESIS OF 4,5-DIHYDRO-PYRAZOLO[3,4-C]PYRID-2-ONES Bristol-Myers Squibb Company (US) 2007-07-11 EP disclosed
WO-2006036926-A2 EFFICIENT SYNTHESIS OF 4,5-DIHYDRO-PYRAZOLO[3,4-C]PYRID-2-ONES BRISTOL-MYERS SQUIBB COMPANY (US) 2006-04-06 WO disclosed
US-20060069119-A1 Efficient synthesis of 4,5-dihydro-pyrazolo[3,4-c]pyrid-2-ones BRISTOL-MYERS SQUIBB COMPANY 2006-03-30 US disclosed
US-20060069119-A1 Efficient synthesis of 4,5-dihydro-pyrazolo[3,4-c]pyrid-2-ones BRISTOL-MYERS SQUIBB COMPANY 2006-03-30 US disclosed
US-20060069119-A1 Efficient synthesis of 4,5-dihydro-pyrazolo[3,4-c]pyrid-2-ones BRISTOL-MYERS SQUIBB COMPANY 2006-03-30 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 (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-20070282106-A1 EFFICIENT SYNTHESIS OF 4,5-DIHYDRO-PYRAZOLO[3,4-c]PYRID-2-ONES F2, TFPI, PDXK F10 35/4885F2 1/4885SLC29A1 4167/4885
US-20060069119-A1 Efficient synthesis of 4,5-dihydro-pyrazolo[3,4-c]pyrid-2-ones F2, TFPI, PDXK F10 35/4885F2 1/4885SLC29A1 4167/4885
US-20080009626-A1 Reacting a 3-leaving group-1-(p-leaving group-phenyl)tetrahydro-2-pyridone with 2-hydroxypyridine and reacting the product with an alpha-oxoacetaldehyde phenylhydrazone to form 1-phenyl-3-carbonyl-6-(p-(2-pyridon-1-yl)phenyl-4,5-dihydro-pyrazolo[3,4-c]pyrid-2-one derivatives; bases; aprotic solvents PDXK, PLPBP, PNPO F10 36/4885F2 6/4885SLC29A1 2253/4885

“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.