SCHEMBL6049474

SCHEMBL6049474

O=C([AsH]Cc1ccc(CNC(=O)c2cccnc2Oc2ccc(F)cc2)cc1)c1cc(F)ccc1O

nearest known ligand 0.71

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 1/20 0.55
PTGER4 P35408 3/20 0.52
PTGER2 P43116 1/20 0.48
KMT2A Q03164 1/20 0.48
LMNA P02545 1/20 0.47
HPGD P15428 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47

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
SCHEMBL6458967 0.93 PTGER4 (0.54) MAPK8PTGER4LMNAHPGDSMN1; SMN2
SCHEMBL4081701 0.91 MAPK8 (0.64) MAPK8PTGER4PTGER2KMT2ALMNA
SCHEMBL4087178 0.85 MAPK8 (0.69) MAPK8PTGER4KMT2ALMNAHPGD
SCHEMBL7317640 0.84 MAPK8 (0.75) MAPK8PTGER4PTGER2KMT2ALMNA
SCHEMBL4085497 0.83 PTGER4 (0.60) MAPK8PTGER4LMNAHPGDSMN1; SMN2
SCHEMBL7371983 0.83 MAPK8 (0.69) MAPK8PTGER4PTGER2KMT2ALMNA
SCHEMBL7168843 0.81 MAPK8 (0.72) MAPK8PTGER4KMT2A
SCHEMBL4085475 0.80 MAPK8 (0.62) MAPK8PTGER4KMT2ALMNAHPGD
SCHEMBL4086021 0.80 MAPK8 (0.59) MAPK8PTGER4LMNAHPGDSMN1; SMN2
SCHEMBL7371446 0.80 LMNA (0.72) MAPK8KMT2ALMNAHPGDSMN1; SMN2

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-1651222-A1 MEDICAMENTS COMPRISING PDE IV INHIBITORS AND AN ANTICHOLINERGIC FOR TREATING RESPIRATORY DISORDERS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2006-05-03 EP claimed
WO-2005013993-A1 MEDICAMENTS COMPRISING PDE IV INHIBITORS AND AN ANTICHOLINERGIC FOR TREATING RESPIRATORY DISORDERS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2005-02-17 WO claimed