SCHEMBL1343527

SCHEMBL1343527

COC(=O)c1cnc(O)cc1O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 5/20 0.52
CA1 P00915 5/20 0.52
CA2 P00918 5/20 0.52
CA7 P43166 5/20 0.52
CA9 Q16790 5/20 0.52
CA14 Q9ULX7 5/20 0.52
PDK2 Q15119 1/20 0.52
PDK4 Q16654 1/20 0.52
GAA P10253 3/20 0.49
LMNA P02545 3/20 0.46
TSHR P16473 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.45
MYC P01106 1/20 0.42
KDM4E B2RXH2 4/20 0.42
XDH P47989 2/20 0.42
POLB P06746 1/20 0.42
NFKB1 P19838 1/20 0.42
GFER P55789 1/20 0.42
NFKB2 Q00653 1/20 0.42
RELA Q04206 1/20 0.42

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
SCHEMBL15632424 0.83 CA12 (0.50) CA12CA1CA2CA7CA9
SCHEMBL31387954 0.81 CA12 (0.49) CA12CA1CA2CA7CA9
SCHEMBL29162628 0.81 CA12 (0.49) CA12CA1CA2CA7CA9
SCHEMBL31387952 0.81 CA12 (0.49) CA12CA1CA2CA7CA9
SCHEMBL8495483 0.81 GAA (0.42) CA12CA1CA2CA7CA9
SCHEMBL24773853 0.81 CA12 (0.49) CA12CA1CA2CA7CA9
SCHEMBL31387953 0.81 CA12 (0.49) CA12CA1CA2CA7CA9
SCHEMBL4635236 0.80 GABRP (0.44) CA12CA1CA2CA7CA9
SCHEMBL502007 0.80 CA12 (0.56) CA12CA1CA2CA7CA9
SCHEMBL15814434 0.78 CA12 (0.41) CA12CA1CA2CA7CA9

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 51 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109794215-B Continuous device for chlorohydroxypyridine and method for continuously chlorohydroxypyridine 凯莱英医药集团(天津)股份有限公司 2024-06-14 CN claimed
CN-109794215-A The method of continuous device and continuous chlorination pyridone substance for chlorination pyridone substance 凯莱英医药集团(天津)股份有限公司 2019-05-24 CN claimed
CN-109794215-B Continuous device for chlorohydroxypyridine and method for continuously chlorohydroxypyridine 凯莱英医药集团(天津)股份有限公司 2024-06-14 CN disclosed
CN-209985424-U Continuous device for chlorinating hydroxypyridine substances 凯莱英医药集团(天津)股份有限公司 2020-01-24 CN disclosed
CN-109794215-A The method of continuous device and continuous chlorination pyridone substance for chlorination pyridone substance 凯莱英医药集团(天津)股份有限公司 2019-05-24 CN disclosed
WO-2019008308-A1 POLARISATION TRANSFER VIA A SECOND METAL COMPLEX UNIVERSITY OF YORK (GB) 2019-01-10 WO disclosed
EP-3052494-B1 AZAINDAZOLE COMPOUNDS AS INHIBITORS OF T790M CONTAINING EGFR MUTANTS HOFFMANN LA ROCHE (CH) 2018-12-26 EP disclosed
US-9951064-B2 Azaindazole compounds as inhibitors of T790M containing EGFR mutants GENENTECH, INC. (US) 2018-04-24 US disclosed
US-9951064-B2 Azaindazole compounds as inhibitors of T790M containing EGFR mutants GENENTECH, INC. (US) 2018-04-24 US disclosed
US-9951064-B2 Azaindazole compounds as inhibitors of T790M containing EGFR mutants GENENTECH, INC. (US) 2018-04-24 US disclosed
US-20160257682-A1 AZAINDAZOLE COMPOUNDS AS INHIBITORS OF T790M CONTAINING EGFR MUTANTS GENENTECH, INC. (US) 2016-09-08 US disclosed
WO-2007089512-A1 GLUCOKINASE ACTIVATORS ARRAY BIOPHARMA INC. (US) 2007-08-09 WO disclosed
WO-2006105023-A1 PYRIDINE DERIVATIVES USEFUL AS INHIBITORS OF PKC-THETA BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2006-10-05 WO disclosed
US-20060217417-A1 PYRIDINE DERIVATIVES USEFUL AS INHIBITORS OF PKC-THETA BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2006-09-28 US disclosed
EP-0909270-B1 PROCESS FOR PREPARING 2,4-DIHYDROXYPYRIDINE AND 2,4-DIHYDROXY-3-NITROPYRIDINE AVENTIS PHARM PROD INC (US) 2002-06-26 EP disclosed
US-6392049-B1 NITRATION USING NITRIC ACID AVENTIS PHARMACEUTICALS INC. 2002-05-21 US disclosed
US-6307054-B1 HEATING A 5-CARBOXY-2,4-DIHYROXYPYRIDINE AND PHOSPHORIC ACID WHERE THE RATIO OF PHOSPHORIC ACID TO WATER IS NOT LESS THAN ABOUT 27 TO 1 WEIGHT %. AVENTIS PHARMACEUTICALS PRODUCTS INC. 2001-10-23 US disclosed
EP-0909270-A4 1999-04-21 EP disclosed
EP-0909270-A1 PROCESS FOR PREPARING 2,4-DIHYDROXYPYRIDINE AND 2,4-DIHYDROXY-3-NITROPYRIDINE RHONE-POULENC RORER PHARMACEUTICALS, INC. (US) 1999-04-21 EP disclosed
WO-1997024327-A1 PROCESS FOR PREPARING 2,4-DIHYDROXYPYRIDINE AND 2,4-DIHYDROXY-3-NITROPYRIDINE RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1997-07-10 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 (2 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-20060217417-A1 PYRIDINE DERIVATIVES USEFUL AS INHIBITORS OF PKC-THETA PRKCQ, PRKCH, PRKCZ CA12 4055/4885CA1 2675/4885CA2 1370/4885
US-20160257682-A1 AZAINDAZOLE COMPOUNDS AS INHIBITORS OF T790M CONTAINING EGFR MUTANTS EGFR, ERBB2, ERBB3 CA12 4643/4885CA1 4853/4885CA2 4735/4885

“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.