SCHEMBL8015189

SCHEMBL8015189

COc1ccc(N/N=C(\Cl)C(C)=O)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.58
CA2 P00918 2/20 0.58
CA4 P22748 1/20 0.58
CA7 P43166 1/20 0.58
MAPT P10636 9/20 0.56
GAA P10253 5/20 0.56
ALDH1A1 P00352 4/20 0.56
MEN1 O00255 4/20 0.56
KMT2A Q03164 4/20 0.56
HTT P42858 2/20 0.56
LMNA P02545 4/20 0.50
GFER P55789 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
RAB9A P51151 3/20 0.49
SMN1; SMN2 Q16637 3/20 0.49
NPC1 O15118 2/20 0.49
TDP1 Q9NUW8 1/20 0.46
L3MBTL1 Q9Y468 2/20 0.45
KYAT1 Q16773 1/20 0.45
TP53 P04637 1/20 0.45

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
SCHEMBL5168032 1.00 CA1 (0.58) CA1CA2CA4CA7MAPT
SCHEMBL5168035 1.00 CA1 (0.58) CA1CA2CA4CA7MAPT
SCHEMBL18660291 0.88 CA1 (0.59) CA1CA2CA4CA7MAPT
SCHEMBL18660293 0.88 CA1 (0.59) CA1CA2CA4CA7MAPT
SCHEMBL1919676 0.87 CA1 (0.58) CA1CA2CA4CA7MAPT
SCHEMBL6501806 0.87 CA1 (0.58) CA1CA2CA4CA7MAPT
SCHEMBL1919310 0.87 CA1 (0.58) CA1CA2CA4CA7MAPT
SCHEMBL518527 0.83 MAPT (0.55) CA1CA2CA4CA7MAPT
SCHEMBL8588938 0.83 HPGD (0.50) CA1CA2CA4CA7MAPT
SCHEMBL8588896 0.83 HPGD (0.50) CA1CA2CA4CA7MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9938272-B2 Hydrazine compound as blood coagulation factor Xa inhibitor NORTH CHINA PHARMACEUTICAL COMPANY., LTD. (CN) 2018-04-10 US disclosed
US-20170152259-A1 HYDRAZINE COMPOUND AS BLOOD COAGULATION FACTOR Xa INHIBITOR NORTH CHINA PHARMACEUTICAL COMPANY., LTD. (CN) 2017-06-01 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-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-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-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 (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-20070282106-A1 EFFICIENT SYNTHESIS OF 4,5-DIHYDRO-PYRAZOLO[3,4-c]PYRID-2-ONES F2, TFPI, PDXK CA1 3083/4885CA2 2470/4885CA4 992/4885
US-20170152259-A1 HYDRAZINE COMPOUND AS BLOOD COAGULATION FACTOR Xa INHIBITOR F12, F10, F11 CA1 240/4885CA2 323/4885CA4 269/4885
US-20060069119-A1 Efficient synthesis of 4,5-dihydro-pyrazolo[3,4-c]pyrid-2-ones F2, TFPI, PDXK CA1 3083/4885CA2 2470/4885CA4 992/4885
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 CA1 1137/4885CA2 1227/4885CA4 1727/4885

“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.