SCHEMBL5765801

SCHEMBL5765801

C1=CC(c2nnc3ccc(Sc4ccccc4)cn23)=C1

nearest known ligand 0.39

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 17/20 0.39
LRRK2 Q5S007 3/20 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
SCHEMBL5766791 0.82 MAPK14 (0.47) MAPK14LRRK2
SCHEMBL5764736 0.76 HSD11B1 (0.44) MAPK14LRRK2
SCHEMBL5764608 0.74 KMT2A (0.54) MAPK14LRRK2
SCHEMBL4823102 0.71 MAPK14 (0.59) MAPK14
SCHEMBL5765041 0.69 KDM4E (0.54) MAPK14LRRK2
SCHEMBL5772885 0.68 MAPK14 (0.69) MAPK14
SCHEMBL5765799 0.68 MAPK14 (0.52) MAPK14LRRK2
SCHEMBL1695290 0.64 CYP3A4 (0.45) MAPK14LRRK2
SCHEMBL23277364 0.61 MAOA (0.62)
SCHEMBL3891151 0.61 MAOA (0.62)

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
EP-1601672-B1 TRIAZOLO-PYRIDINES AS ANTI-INFLAMMATORY COMPOUNDS PFIZER PROD INC (US) 2006-07-26 EP disclosed