SCHEMBL8577198

SCHEMBL8577198

CCOC=Nc1cc[nH]n1

nearest known ligand 0.39

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 3/20 0.39
MAPK1 P28482 1/20 0.32

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
SCHEMBL1680536 0.70
SCHEMBL18355468 0.69 L3MBTL1 (0.42)
SCHEMBL8464490 0.69 L3MBTL1 (0.42)
SCHEMBL10765458 0.69 ADRA2A (0.45) PTGS2MAPK1
SCHEMBL10765464 0.69 ADRA2A (0.45) PTGS2MAPK1
SCHEMBL1569120 0.66
SCHEMBL4295351 0.65
SCHEMBL5206443 0.65
SCHEMBL4361000 0.64 PTGS2 (0.50) PTGS2MAPK1
SCHEMBL4361001 0.64 PTGS2 (0.50) PTGS2MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1998014449-A1 FUSED PYRAZOLE DERIVATIVES AND PROCESSES FOR THEIR PREPARATION NOVARTIS AG (CH) 1998-04-09 WO disclosed