SCHEMBL5764665

SCHEMBL5764665

OCc1ccccc1Sc1ccc2nnc(C3CCC3)n2c1

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 14/20 0.48
HSD11B1 P28845 2/20 0.35
APOBEC3G Q9HC16 1/20 0.34
LDHA P00338 1/20 0.34
RAB9A P51151 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
CHRNA7 P36544 1/20 0.33

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
SCHEMBL5765799 0.80 MAPK14 (0.52) MAPK14RAB9ANPSR1
SCHEMBL5766666 0.80 MAPK14 (0.50) MAPK14RAB9A
SCHEMBL4825090 0.75 MAPK14 (0.67) MAPK14APOBEC3G
SCHEMBL5766104 0.75 MAPK14 (0.56) MAPK14APOBEC3G
SCHEMBL14435024 0.75 MAPK14 (0.36) MAPK14
SCHEMBL5765435 0.74 MAPK14 (0.48) MAPK14HSD11B1
SCHEMBL5764666 0.74 MAPK14 (0.42) MAPK14APOBEC3G
SCHEMBL4079695 0.73 MAPK14 (0.46) MAPK14
SCHEMBL14435664 0.73 MAPK14 (0.34) MAPK14
SCHEMBL10364829 0.73 FLT1 (0.46) MAPK14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7321040-B2 Triazolo-pyridines as anti-inflammatory compounds PFIZER INC. (US) 2008-01-22 US disclosed
US-7321040-B2 Triazolo-pyridines as anti-inflammatory compounds PFIZER INC. (US) 2008-01-22 US disclosed
EP-1601672-B1 TRIAZOLO-PYRIDINES AS ANTI-INFLAMMATORY COMPOUNDS PFIZER PROD INC (US) 2006-07-26 EP disclosed