SCHEMBL17049788

SCHEMBL17049788

C[C@H]1NC(=O)[C@@H]1NC(=O)OC(C)(C)C

nearest known ligand 0.57

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ NAAA Q02083 3/20 0.49
▸ GAA P10253 1/20 0.49
▸ NFKB1 P19838 7/20 0.44
▸ NFKB2 Q00653 7/20 0.44
▸ RELA Q04206 7/20 0.44
▸ EPHX2 P34913 1/20 0.38
▸ BTK Q06187 1/20 0.36

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
SCHEMBL10660414 1.00 NAAA (0.49) NAAAGAANFKB1NFKB2RELA
SCHEMBL10665432 1.00 NAAA (0.49) NAAAGAANFKB1NFKB2RELA
SCHEMBL10832796 1.00 NAAA (0.49) NAAAGAANFKB1NFKB2RELA
SCHEMBL10472944 1.00 NAAA (0.49) NAAAGAANFKB1NFKB2RELA
SCHEMBL10683017 1.00 NAAA (0.49) NAAAGAANFKB1NFKB2RELA
SCHEMBL24187616 0.90 GAA (0.47) NAAAGAANFKB1NFKB2RELA
SCHEMBL24187610 0.90 GAA (0.47) NAAAGAANFKB1NFKB2RELA
SCHEMBL24187613 0.90 GAA (0.47) NAAAGAANFKB1NFKB2RELA
SCHEMBL24187612 0.90 GAA (0.47) NAAAGAANFKB1NFKB2RELA
SCHEMBL15621646 0.80 IDO1 (0.47) GAANFKB1NFKB2RELAEPHX2

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-9120892-B2 Poly-β-peptides from functionalized β-lactam monomers and antibacterial compositions containing same WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2015-09-01 — — US disclosed
Send feedback