SCHEMBL7452471

SCHEMBL7452471

NC(=O)c1cn(C(CO)c2ccccc2)cn1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ADA P00813 13/20 1.00
KDM4C Q9H3R0 1/20 0.43
SRC P12931 2/20 0.39

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
SCHEMBL30724486 0.85 ADA (0.74) ADA
SCHEMBL9714567 0.79 ADA (0.66) ADA
Fr-221647 SCHEMBL7659103 0.76 ADA (1.00) ADA
SCHEMBL7661354 0.76 ADA (0.66) ADA
SCHEMBL7827340 0.76 ADA (0.61) ADAKDM4C
SCHEMBL7260042 0.74 ADA (0.59) ADAKDM4C
SCHEMBL6173265 0.74 ADA (0.59) ADA
SCHEMBL7664339 0.72 ADA (0.69) ADA
SCHEMBL7661357 0.70 ADA (0.58) ADA
SCHEMBL7659109 0.70 ADA (0.66) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1291979-C Imidazole compounds and their use as adenosine deaminase inhibitors JUJISAWA PHARAMCEUTICAL CO LTD (JP) 2006-12-27 CN disclosed
US-6359145-B1 ADENOSINE DEAMINASE INHIBITOR; ANTIINFLAMMATORY AGENTS; IMMUNOSUPPRESSANT FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-03-19 US disclosed
CN-1319095-A Imidazole compounds and their use as adenosine deaminase inhibitors JUJISAWA PHARAMCEUTICAL CO LTD (JP) 2001-10-24 CN disclosed
WO-2001026605-A2 IMMUNOSUPPRESSIVE COMPOSITION CONTAINING IL-2 INHIBITOR AND AN ADENOSINE DEAMINASE INHIBITOR FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-04-19 WO disclosed