SCHEMBL6747565

SCHEMBL6747565

Cc1cc(-c2ocnc2-c2cccc(Cl)c2)ccn1

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 5/20 0.51
GRM2 Q14416 1/20 0.47
TDO2 P48775 4/20 0.44
HCRTR1 O43613 1/20 0.42
HCRTR2 O43614 1/20 0.42
PTGS1 P23219 1/20 0.41
PTGS2 P35354 1/20 0.41
GRM5 P41594 1/20 0.39
PIM1 P11309 1/20 0.39
NOTUM Q6P988 1/20 0.39
MAPK1 P28482 2/20 0.38
CNR2 P34972 2/20 0.38

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
SCHEMBL1387159 0.83 MAPK14 (0.55) MAPK14TDO2PTGS1PTGS2PIM1
SCHEMBL2615985 0.81 CNR2 (0.50) GRM2TDO2PIM1NOTUMCNR2
SCHEMBL9953638 0.76 NOTUM (0.47) MAPK14HCRTR1HCRTR2PTGS1PTGS2
SCHEMBL1387318 0.76 MAPK14 (0.66) MAPK14
SCHEMBL5257164 0.72 GRM2 (0.43) MAPK14GRM2TDO2PTGS1PTGS2
SCHEMBL7857724 0.72 LRRK2 (0.58) MAPK14GRM2MAPK1
SCHEMBL5255541 0.72 GRM2 (0.46) MAPK14GRM2TDO2MAPK1
SCHEMBL11754023 0.72 MAPK14 (0.50) MAPK14HCRTR1HCRTR2PTGS1PTGS2
SCHEMBL11754854 0.72 MAPK14 (0.53) MAPK14HCRTR1HCRTR2PTGS1PTGS2
SCHEMBL6185308 0.69 MAPK14 (0.70) MAPK14HCRTR1HCRTR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040106793-A1 Oxazoles for treating cytokine mediated diseases SMITHKLINE BEECHAM CORPORATION 2004-06-03 US disclosed
EP-1306377-A2 Pyridyl-oxazoles and their use as cytokines inhibitors SMITHKLINE BEECHAM CORPORATION (US) 2003-05-02 EP disclosed
US-20020169173-A1 Oxazoles for treating cytokine mediated diseases SMITHKLINE BEECHAM CORPORATION 2002-11-14 US disclosed
US-6288062-B1 INTERLEUKIN AND TUMOR NECROSIS FACTOR INHIBITORS; ANTIINFLAMMATORY AGENTS; RHEUMATIC DISEASES; ANTIARTHRITIC AGENTS; RESPIRATORY SYSTEM DISORDERS SMITHKLINE BEECHAM CORPORATION 2001-09-11 US disclosed
EP-0727998-A4 OXAZOLES FOR TREATING CYTOKINE MEDIATED DISEASES SMITHKLINE BEECHAM CORP (US) 1997-03-19 EP disclosed
EP-0727998-A1 OXAZOLES FOR TREATING CYTOKINE MEDIATED DISEASES SMITHKLINE BEECHAM CORPORATION (US) 1996-08-28 EP disclosed
WO-1995013067-A1 OXAZOLES FOR TREATING CYTOKINE MEDIATED DISEASES SMITHKLINE BEECHAM CORPORATION (US) 1995-05-18 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-20040106793-A1 Oxazoles for treating cytokine mediated diseases IL2, IL17A, IL5 MAPK14 709/4885GRM2 1780/4885TDO2 746/4885
US-20020169173-A1 Oxazoles for treating cytokine mediated diseases IL17A, IL4I1, IL2 MAPK14 870/4885GRM2 1272/4885TDO2 1156/4885

“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.