SCHEMBL31033288

SCHEMBL31033288

CC1(O)CNc2cc(C=CC(=O)O)cnc2NC1=O

nearest known ligand 0.39

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.38
P4HTM Q9NXG6 1/20 0.35
ALOX5 P09917 1/20 0.33

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
SCHEMBL21964051 1.00 RAB9A (0.38) RAB9AP4HTMALOX5
SCHEMBL22010492 0.89 RAB9A (0.41) RAB9AP4HTMALOX5
SCHEMBL22010916 0.85
SCHEMBL31033280 0.85
SCHEMBL30161226 0.85
Trifluoroacetic Acid SCHEMBL21963918 0.83 RAB9A (0.37) RAB9AP4HTM
SCHEMBL22010721 0.80 RAB9A (0.41) RAB9AP4HTMALOX5
SCHEMBL4101563 0.77
SCHEMBL4101570 0.77
SCHEMBL21963751 0.77 KDM4E (0.34)

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-113272302-B Antibiotic compound, method for producing same, pharmaceutical composition containing same, and use thereof 德彪药业国际股份公司 2024-08-13 CN disclosed