SCHEMBL7664367

SCHEMBL7664367

CNC(=O)c1cn([C@H](CCc2cccc3ccccc23)[C@H](C)O)cn1

nearest known ligand 0.78

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ADA P00813 6/20 0.78
MTNR1A P48039 1/20 0.42

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
SCHEMBL7661656 0.88 ADA (0.72) ADA
SCHEMBL6171724 0.88 ADA (0.79) ADA
SCHEMBL7661722 0.88 ADA (0.78) ADA
SCHEMBL6172027 0.88 ADA (1.00) ADA
SCHEMBL6168397 0.88 ADA (1.00) ADA
Acetic Acid SCHEMBL7671466 0.86 ADA (0.75) ADA
SCHEMBL6174229 0.82 ADA (0.88) ADA
SCHEMBL7664374 0.77 ADA (0.47) ADAMTNR1A
SCHEMBL6133236 0.77 ADA (0.79) ADA
SCHEMBL6171728 0.77 ADA (0.61) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6359145-B1 ADENOSINE DEAMINASE INHIBITOR; ANTIINFLAMMATORY AGENTS; IMMUNOSUPPRESSANT FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-03-19 US disclosed