SCHEMBL6169467

SCHEMBL6169467

NC(=O)c1cn(C[C@H](CCCCc2ccccc2)OCc2ccccc2)cn1

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ADA P00813 10/20 0.48
FAAH O00519 3/20 0.41
LPAR1 Q92633 1/20 0.37
PLA2G4A P47712 1/20 0.37
KMT2A Q03164 1/20 0.36
LMNA P02545 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
SCHEMBL6169457 0.97 ADA (0.49) ADAFAAHLPAR1PLA2G4AKMT2A
SCHEMBL5671897 0.90 ADA (0.47) ADAKMT2A
SCHEMBL6170057 0.88 ADA (0.51) ADAFAAHKMT2A
SCHEMBL6171229 0.87 ADA (0.42) ADALPAR1
SCHEMBL6171160 0.86 ADA (0.44) ADALPAR1
SCHEMBL6173056 0.86 ADA (0.44) ADALPAR1
SCHEMBL6169584 0.85 ADA (0.52) ADAKMT2A
SCHEMBL6173997 0.85 ADA (0.42) ADALPAR1KMT2ALMNA
SCHEMBL6135524 0.84 ADA (0.39) ADALPAR1
SCHEMBL6172589 0.84 ADA (0.49) ADALPAR1

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
EP-1098885-B9 IMIDAZOLE COMPOUNDS AND THEIR USE AS ADENOSINE DEAMINASE INHIBITORS FUJISAWA PHARMACEUTICAL CO (JP) 2005-05-18 EP disclosed
EP-1098885-B1 IMIDAZOLE COMPOUNDS AND THEIR USE AS ADENOSINE DEAMINASE INHIBITORS FUJISAWA PHARMACEUTICAL CO (JP) 2004-11-17 EP disclosed
US-6359145-B1 ADENOSINE DEAMINASE INHIBITOR; ANTIINFLAMMATORY AGENTS; IMMUNOSUPPRESSANT FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-03-19 US disclosed