SCHEMBL28650727

SCHEMBL28650727

[CH2]c1ccc(NC(=O)C(CCCNC(N)=O)NC(=O)C(NC(=O)COCCOCCOCCN=[N+]=[N-])C(C)C)cc1

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ FURIN P09958 10/20 0.39
▸ C3AR1 Q16581 1/20 0.37
▸ HTT P42858 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ ROCK2 O75116 1/20 0.34
▸ CTSL P07711 1/20 0.33
▸ KLKB1 P03952 2/20 0.33
▸ MAP1LC3B Q9GZQ8 2/20 0.32

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
SCHEMBL28580456 1.00 FURIN (0.39) FURINC3AR1HTTSMN1; SMN2ROCK2
SCHEMBL25361709 0.94 FURIN (0.37) FURINC3AR1HTTSMN1; SMN2ROCK2
SCHEMBL25360798 0.94 FURIN (0.37) FURINC3AR1HTTSMN1; SMN2ROCK2
SCHEMBL28592858 0.92 FURIN (0.41) FURINC3AR1HTTSMN1; SMN2ROCK2
SCHEMBL17637464 0.92 FURIN (0.41) FURINC3AR1HTTSMN1; SMN2ROCK2
SCHEMBL28592862 0.92 FURIN (0.41) FURINC3AR1HTTSMN1; SMN2ROCK2
SCHEMBL22690514 0.92 FURIN (0.41) FURINC3AR1HTTSMN1; SMN2ROCK2
SCHEMBL22690491 0.91 FURIN (0.41) FURINC3AR1HTTSMN1; SMN2ROCK2
SCHEMBL17637465 0.91 FURIN (0.41) FURINC3AR1HTTSMN1; SMN2ROCK2
SCHEMBL28604515 0.90 FURIN (0.41) FURINC3AR1

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-113663067-A Immune activation type antibody and application thereof 深圳市康居正医药科技有限公司 2021-11-19 — — CN disclosed
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