SCHEMBL6206892

SCHEMBL6206892

COc1ccc(Sc2ccc(F)cc2Cl)nn1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 4/20 0.41
PDE10A Q9Y233 4/20 0.41
PDE6D O43924 2/20 0.41
PDE6A P16499 2/20 0.41
PDE6G P18545 2/20 0.41
PDE6B P35913 2/20 0.41
PDE6C P51160 2/20 0.41
PDE6H Q13956 2/20 0.41
MAPK14 Q16539 6/20 0.40
MAPK11 Q15759 4/20 0.40
MAPK13 O15264 1/20 0.40
MAPK12 P53778 1/20 0.40
MCHR1 Q99705 1/20 0.38
PDE7A Q13946 1/20 0.37
L3MBTL1 Q9Y468 2/20 0.36
KDM4E B2RXH2 1/20 0.36
ATM Q13315 1/20 0.36
ALDH1A1 P00352 2/20 0.34
HTT P42858 1/20 0.34
PTPN11 Q06124 1/20 0.34

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
SCHEMBL6207374 0.78 HAO1 (0.45) PDE2APDE10APDE6DPDE6APDE6G
SCHEMBL6206688 0.74 ALDH1A1 (0.41) MAPK14MAPK11MAPK13MAPK12MCHR1
SCHEMBL6205612 0.73 MAPK14 (0.35) MAPK14L3MBTL1LMNAMAPT
SCHEMBL28941715 0.73 ATM (0.50) MAPK14MAPK11MAPK13MAPK12PDE7A
SCHEMBL16155562 0.72 HTT (0.49) MAPK14MAPK11MAPK13MAPK12PDE7A
SCHEMBL6206810 0.72 HAO1 (0.45) MAPK14MAPK11L3MBTL1KDM4EPTPN11
SCHEMBL6205763 0.67 EGFR (0.45) MAPK14MAPK11MAPK13MAPK12KDM4E
SCHEMBL643072 0.66 ATM (0.41) MAPK14MAPK11MAPK13MAPK12L3MBTL1
SCHEMBL6205585 0.66 AKR1B1 (0.54) PDE2APDE10APDE6DPDE6APDE6G
SCHEMBL1255217 0.65 ATM (0.39) MAPK14MAPK11MAPK13MAPK12PDE7A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1236720-B1 Sulfonyl pyridazinone compounds useful as aldose reductase inhibitors PFIZER PROD INC (US) 2005-06-15 EP disclosed
US-6872722-B2 Therapies for tissue damage resulting from ischemia PFIZER INC (US) 2005-03-29 US disclosed
EP-1260224-B1 Sulfonyl pyridazinone compounds as therapeutic agents for ischemic tissue damage PFIZER PROD INC (US) 2005-02-23 EP disclosed
US-20050004124-A1 THERAPIES RELATING TO COMBINATIONS OF ALDOSE REDUCTASE INHIBITORS AND CYCLOOXYGENASE-2 INHIBITORS MYLARI BANAVARA L (US) 2005-01-06 US disclosed
US-20040198740-A1 Therapies relating to combinations of aldose reductase inhibitors and cyclooxygenase-2 PFIZER INC 2004-10-07 US disclosed
US-6730674-B2 ANTIDIABETIC AGENTS PFIZER INC 2004-05-04 US disclosed
EP-1392310-A1 COMBINATIONS OF ALDOSE REDUCTASE INHIBITORS AND CYCLOOXYGENASE-2 INHIBITORS Pfizer Products Inc. (US) 2004-03-03 EP disclosed
US-20030008871-A1 Therapies for tissue damage resulting from ischemia MYLARI BANAVARA L (US) 2003-01-09 US disclosed
US-20030004139-A1 Sulfonyl pyridazinone compounds useful as aldose reductase inhibitors MARTIN WILLIAM H (US) 2003-01-02 US disclosed
EP-1260224-A1 Sulfonyl pyridazinone compounds as therapeutic agents for ischemic tissue damage Pfizer Products Inc. (US) 2002-11-27 EP disclosed
WO-2002087584-A1 COMBINATIONS OF ALDOSE REDUCTASE INHIBITORS AND CYCLOOXYGENASE-2 INHIBITORS PFIZER PRODUCTS INC. (US) 2002-11-07 WO disclosed
EP-1236720-A1 Sulfonyl pyridazinone compounds useful as aldose reductase inhibitors Pfizer Products Inc. (US) 2002-09-04 EP 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-20050004124-A1 THERAPIES RELATING TO COMBINATIONS OF ALDOSE REDUCTASE INHIBITORS AND CYCLOOXYGENASE-2 INHIBITORS ALDOA, AKR1B1, ALDH2 PDE2A 369/4885PDE10A 1807/4885PDE6D 1028/4885
US-20040198740-A1 Therapies relating to combinations of aldose reductase inhibitors and cyclooxygenase-2 ALDOA, ALDH2, AKR1B1 PDE2A 363/4885PDE10A 1767/4885PDE6D 993/4885
US-20030008871-A1 Therapies for tissue damage resulting from ischemia TNNI3, TNNC1, TNNT2 PDE2A 781/4885PDE10A 2177/4885PDE6D 2484/4885
US-20030004139-A1 Sulfonyl pyridazinone compounds useful as aldose reductase inhibitors ALDOA, PDXK, AKR1B1 PDE2A 1597/4885PDE10A 3091/4885PDE6D 1431/4885

“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.