SCHEMBL5789094

SCHEMBL5789094

Cc1c(C(=O)NN)cc(C(=O)O)c(=O)n1-c1cccc(C(F)(F)F)c1

nearest known ligand 0.62

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 5/20 0.62
ELANE P08246 3/20 0.48
ATM Q13315 1/20 0.47
CCR1 P32246 1/20 0.47
LMNA P02545 1/20 0.46
MAPT P10636 1/20 0.46
POLB P06746 1/20 0.44
CYP1A2 P05177 1/20 0.43
GSR P00390 1/20 0.43
ALKBH5 Q6P6C2 1/20 0.42
FAAH O00519 1/20 0.41
PLA2G10 O15496 1/20 0.41
TRPV4 Q9HBA0 1/20 0.41

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
SCHEMBL5752612 0.90 NOTUM (0.76) NOTUMELANELMNAMAPTPOLB
SCHEMBL29808797 0.90 NOTUM (0.76) NOTUMELANELMNAMAPTPOLB
SCHEMBL4022781 0.83 NOTUM (0.63) NOTUMELANELMNAMAPTPOLB
SCHEMBL4152306 0.83 NOTUM (0.62) NOTUMELANELMNAMAPTPOLB
SCHEMBL8065166 0.82 NOTUM (0.65) NOTUMELANELMNAMAPTPOLB
SCHEMBL984085 0.81 NOTUM (0.64) NOTUMELANELMNAMAPTPOLB
SCHEMBL29875297 0.81 ELANE (0.75) ELANE
SCHEMBL560793 0.81 ELANE (0.75) ELANE
SCHEMBL4157208 0.80 NOTUM (0.56) NOTUMELANELMNAMAPTPOLB
SCHEMBL8063220 0.80 NOTUM (0.61) NOTUMELANELMNAMAPTPOLB

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-1663974-A1 2-PYRIDONE DERIVATIVES AS NETROPHIL ELASTASE INHIBITORS AND THEIR USE AstraZeneca AB (SE) 2006-06-07 EP disclosed
WO-2005026124-A1 2-PYRIDONE DERIVATIVES AS NETROPHIL ELASTASE INHIBITORS AND THEIR USE ASTRAZENECA AB (SE) 2005-03-24 WO disclosed