Sugi Predict

Sugi Predict / Compounds / SCHEMBL9901668

SCHEMBL9901668

SCHEMBL9901668

Cc1c(OCc2ccc(F)cc2F)c(Cl)c(=O)n(-c2ccnc(-c3ccnc(C(C)(C)O)n3)c2)c1C

nearest known ligand 0.61

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ MAPKAPK2 P49137 3/20 0.61
▸ MAPKAPK5 Q8IW41 1/20 0.49
▸ MAPK14 Q16539 16/20 0.40
▸ PTGER1 P34995 1/20 0.35

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
SCHEMBL9905630 0.89 MAPKAPK2 (0.48) MAPKAPK2MAPKAPK5MAPK14PTGER1
SCHEMBL9111179 0.86 MAPKAPK2 (0.79) MAPKAPK2MAPKAPK5MAPK14
SCHEMBL9902573 0.85 MAPKAPK2 (0.45) MAPKAPK2MAPK14
SCHEMBL9109796 0.84 MAPKAPK2 (0.68) MAPKAPK2MAPKAPK5MAPK14
SCHEMBL9904956 0.81 MAPKAPK2 (0.41) MAPKAPK2MAPKAPK5
SCHEMBL9905266 0.81 MAPKAPK2 (0.41) MAPKAPK2MAPKAPK5
SCHEMBL9900903 0.81 MAPKAPK2 (0.46) MAPKAPK2MAPKAPK5MAPK14
SCHEMBL9110845 0.81 MAPKAPK2 (0.66) MAPKAPK2MAPK14
SCHEMBL9905675 0.80 MAPK14 (0.44) MAPKAPK2MAPKAPK5MAPK14PTGER1
SCHEMBL9109912 0.79 MAPKAPK2 (0.78) MAPKAPK2MAPKAPK5MAPK14

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-2648516-A1 SUBSTITUTED PYRIDINONE-PYRIDINYL COMPOUNDS Confluence Life Sciences, Inc. (US) 2013-10-16 — — EP disclosed
WO-2012078684-A1 SUBSTITUTED PYRIDINONE-PYRIDINYL COMPOUNDS CONFLUENCE LIFE SCIENCES, INC. (US) 2012-06-14 — — WO disclosed