SCHEMBL7495308

SCHEMBL7495308

Fc1ccc(-c2oncc2-c2ccnc(Cl)c2)cc1

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 9/20 0.45
TDO2 P48775 1/20 0.43
MAPK13 O15264 3/20 0.41
MAPK12 P53778 3/20 0.41
MAPK11 Q15759 3/20 0.41
S1PR1 P21453 1/20 0.39
S1PR3 Q99500 1/20 0.39
IDO1 P14902 1/20 0.37
RPS6KA3 P51812 1/20 0.36
GRM5 P41594 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
TGFBR1 P36897 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
SCHEMBL8836231 0.85 TDO2 (0.45) MAPK14TDO2MAPK13MAPK12MAPK11
SCHEMBL7495163 0.83 TDO2 (0.43) MAPK14TDO2IDO1RPS6KA3TGFBR1
SCHEMBL7496200 0.79 MAPK14 (0.58) MAPK14TDO2MAPK13MAPK12MAPK11
SCHEMBL6095042 0.78 TDO2 (0.38) MAPK14TDO2MAPK13MAPK12MAPK11
SCHEMBL4932513 0.76 MAPK14 (0.52) MAPK14MAPK13MAPK12MAPK11S1PR1
SCHEMBL8836017 0.71 TDO2 (0.54) MAPK14TDO2GRM5TGFBR1
SCHEMBL3273312 0.70 KMO (0.42) MAPK14MAPK13MAPK12MAPK11IDO1
SCHEMBL30224316 0.70 KMO (0.42) MAPK14MAPK13MAPK12MAPK11IDO1
SCHEMBL8836756 0.70 MAPK14 (0.50) MAPK14TDO2MAPK13MAPK12MAPK11
SCHEMBL5256356 0.69 TDO2 (0.54) MAPK14TDO2RPS6KA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0686156-B1 PYRAZOLITRIAZINES WITH INTERLEUKIN-1 AND TUMOUR NECROSIS FACTOR INHIBITORY ACTIVITY FUJISAWA PHARMACEUTICAL CO (JP) 2002-07-17 EP disclosed
CN-1041929-C Pyrazolitriazines with interleukin-1 and tumour necrosis factor inhibitory activity FUJISAWA PHARMACEUTICAL CO (JP) 1999-02-03 CN disclosed
US-5670503-A PROPHYLACTIC AND THERAPEUTIC TREATMENT OF INTERLEUKIN-1 AND TUMOR NECROSIS FACTOR MEDIATED DISEASES SUCH AS INFLAMMATORY DISEASES, AUTOIMMUNE DISEASES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-09-23 US disclosed
CN-1120840-A Pyrazolitriazines with interleukin-1 and tumour necrosis factor inhibitory activity FUJISAWA PHARAMCEUTICAL CO LTD (JP) 1996-04-17 CN disclosed
EP-0686156-A1 PYRAZOLITRIAZINES WITH INTERLEUKIN-1 AND TUMOUR NECROSIS FACTOR INHIBITORY ACTIVITY FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1995-12-13 EP disclosed
WO-1994019350-A1 PYRAZOLITRIAZINES WITH INTERLEUKIN-1 AND TUMOUR NECROSIS FACTOR INHIBITORY ACTIVITY FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1994-09-01 WO disclosed