SCHEMBL30601899

SCHEMBL30601899

CCCCCCCCCCCCOC(=O)C(Cc1ccccc1)NC(=O)OC(C)(C)C

nearest known ligand 0.67

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CTSK P43235 4/20 0.57
CTSS P25774 3/20 0.57
CTSL P07711 1/20 0.57
CTSB P07858 1/20 0.57
BCHE P06276 1/20 0.56
ACHE P22303 1/20 0.56
ACE P12821 1/20 0.55
KLK5 Q9Y337 1/20 0.53
TLR2 O60603 1/20 0.51
TLR1 Q15399 1/20 0.51

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
SCHEMBL25526194 1.00 CTSK (0.57) CTSKCTSSCTSLCTSBBCHE
SCHEMBL25526175 1.00 CTSK (0.57) CTSKCTSSCTSLCTSBBCHE
SCHEMBL25526055 1.00 CTSK (0.57) CTSKCTSSCTSLCTSBBCHE
SCHEMBL25526189 1.00 CTSK (0.57) CTSKCTSSCTSLCTSBBCHE
SCHEMBL29830632 1.00 CTSK (0.57) CTSKCTSSCTSLCTSBBCHE
SCHEMBL29830683 1.00 CTSK (0.57) CTSKCTSSCTSLCTSBBCHE
SCHEMBL29830908 1.00 CTSK (0.57) CTSKCTSSCTSLCTSBBCHE
SCHEMBL30219144 1.00 CTSK (0.57) CTSKCTSSCTSLCTSBBCHE
SCHEMBL8661246 1.00 CTSK (0.57) CTSKCTSSCTSLCTSBBCHE
SCHEMBL25526177 1.00 CTSK (0.57) CTSKCTSSCTSLCTSBBCHE

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
WO-2023212650-A1 NEXT GENERATION DIPROVOCIMS THAT ACTIVATE THE INNATE AND ADAPTIVE IMMUNE RESPONSE THE SCRIPPS RESEARCH INSTITUTE (US) 2023-11-02 WO disclosed