SCHEMBL5133399

SCHEMBL5133399

CC(C)(C)OC(=O)C1C=CC=CC1(F)[N+](=O)[O-]

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.31

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
SCHEMBL2458974 0.78
SCHEMBL9849643 0.76
SCHEMBL4694810 0.76
SCHEMBL486744 0.70 MAPK1 (0.34) MAPK1
SCHEMBL28026340 0.70
SCHEMBL1592496 0.69
SCHEMBL6410731 0.69
Hydrochloric Acid SCHEMBL29024517 0.67 MAPK1 (0.32) MAPK1
SCHEMBL996242 0.67 MAPK1 (0.32) MAPK1
Hydrochloric Acid SCHEMBL29024671 0.67 MAPK1 (0.32) MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1999131-A2 BICYCLO-PYRAZOLES ACTIVE AS KINASE INHIBITORS Nerviano Medical Sciences S.r.l. (IT) 2008-12-10 EP disclosed
WO-2007099171-A2 BICYCLO-PYRAZOLES ACTIVE AS KINASE INHIBITORS NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2007-09-07 WO disclosed