SCHEMBL28544491

SCHEMBL28544491

CCCCN(C(=O)Oc1ccc(Cl)c2c1B(O)OC2CN)C(C)(C)C

nearest known ligand 0.62

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
LARS1 Q9P2J5 2/20 0.57

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
SCHEMBL28545547 0.94 LARS1 (0.59) LARS1
SCHEMBL28552990 0.87 LARS1 (0.42) LARS1
SCHEMBL28551389 0.81 LARS1 (0.43) LARS1
SCHEMBL461317 0.81 LARS1 (0.60) LARS1
SCHEMBL5019556 0.77 LARS1 (0.80) LARS1
SCHEMBL469387 0.73 LARS1 (1.00) LARS1
Hydrochloric Acid SCHEMBL460390 0.73 LARS1 (1.00) LARS1
Hydrochloric Acid SCHEMBL2679248 0.73 LARS1 (1.00) LARS1
Hydrochloric Acid SCHEMBL2680125 0.73 LARS1 (1.00) LARS1
SCHEMBL28557352 0.72 BCHE (0.30)

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
CN-108610356-B Benzoxaborole derivatives for the treatment of bacterial infections 阿纳科制药公司 2021-02-26 CN disclosed