SCHEMBL25007337

SCHEMBL25007337

COC(=O)[C@H](C[C@@H]1CCNC1=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)OCCCc1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CTSL P07711 6/20 0.51
CTSB P07858 5/20 0.51
CAPN1 P07384 1/20 0.51
CTSS P25774 1/20 0.50
CTSK P43235 1/20 0.50
CTSF Q9UBX1 1/20 0.50

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
SCHEMBL25766979 0.89 CTSL (0.63) CTSLCTSBCAPN1CTSSCTSK
SCHEMBL25007333 0.89 CTSL (0.50) CTSLCTSBCAPN1CTSSCTSK
SCHEMBL25007338 0.88 CTSL (0.51) CTSLCTSBCAPN1CTSSCTSK
SCHEMBL25007334 0.87 CTSL (0.57) CTSLCTSBCAPN1
SCHEMBL25007336 0.84 CTSL (0.54) CTSLCTSBCAPN1CTSSCTSK
SCHEMBL25522676 0.84 CTSL (0.59) CTSLCTSBCAPN1CTSSCTSK
SCHEMBL30174547 0.83 CTSL (0.55) CTSLCTSBCAPN1CTSSCTSK
SCHEMBL25765342 0.83 CTSL (0.56) CTSLCTSBCAPN1CTSSCTSK
SCHEMBL25525725 0.82 CTSL (0.59) CTSLCTSBCAPN1CTSSCTSK
SCHEMBL14838024 0.82 CTSL (0.73) CTSLCTSBCAPN1CTSSCTSK

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-2023014758-A1 INHIBITORS FOR CORONAVIRUSES COCRYSTAL PHARMA, INC. (US) 2023-02-09 WO disclosed