SCHEMBL6173047

SCHEMBL6173047

C[C@H](OCc1ccccc1)[C@H](CCc1cccc2ccccc12)n1cnc(C(N)=O)c1

nearest known ligand 0.73

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ADA P00813 13/20 0.73
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.37
PARP10 Q53GL7 1/20 0.37

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
SCHEMBL6169583 1.00 ADA (0.73) ADAKMT2AMEN1PARP10
SCHEMBL6169932 1.00 ADA (0.73) ADAKMT2AMEN1PARP10
SCHEMBL6170051 0.95 ADA (0.65) ADAKMT2AMEN1
SCHEMBL7667837 0.93 ADA (0.61) ADAKMT2A
SCHEMBL6133486 0.91 ADA (0.60) ADA
SCHEMBL6133576 0.91 ADA (0.60) ADA
SCHEMBL6170680 0.90 ADA (0.58) ADAKMT2AMEN1
SCHEMBL6169449 0.90 ADA (0.60) ADA
SCHEMBL6171150 0.88 ADA (0.55) ADA
SCHEMBL6172227 0.87 ADA (0.55) ADA

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