SCHEMBL5765239

SCHEMBL5765239

CCc1nnc2ccc(Sc3ccc(F)cc3)cn12

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 17/20 0.53
MAPK13 O15264 1/20 0.48
SCN5A Q14524 1/20 0.39
MEN1 O00255 1/20 0.38
HPGD P15428 1/20 0.38
KMT2A Q03164 1/20 0.38
NOTUM Q6P988 1/20 0.38

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
SCHEMBL5765684 0.87 MAPK14 (0.49) MAPK14MAPK13HPGDNOTUM
SCHEMBL13687352 0.82 MAPK14 (0.58) MAPK14MAPK13SCN5AHPGD
SCHEMBL11488779 0.80 MAPK14 (0.67) MAPK14SCN5AHPGD
SCHEMBL5765074 0.77 MAPK14 (0.72) MAPK14MAPK13
SCHEMBL5765754 0.71 MAPK14 (0.43) MAPK14MAPK13NOTUM
SCHEMBL16686975 0.71 MAPK14 (0.47) MAPK14SCN5A
SCHEMBL5766110 0.70 MAPK14 (0.47) MAPK14MAPK13MEN1HPGDKMT2A
SCHEMBL5773810 0.70 MAPK14 (1.00) MAPK14
SCHEMBL13687351 0.69 POLB (0.46) MAPK14
SCHEMBL13687337 0.69 SCN5A (0.50) MAPK14SCN5A

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