SCHEMBL28951502

SCHEMBL28951502

O=C(NC(CC1CCCCC1)C(=O)NC(CO)C[C@@H]1CCNC1=O)OCc1cccc(Cl)c1

nearest known ligand 0.61

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CTSL P07711 5/20 0.60
CTSB P07858 4/20 0.60
CAPN1 P07384 1/20 0.49
CTSS P25774 1/20 0.46
CTSK P43235 1/20 0.46
CTSF Q9UBX1 1/20 0.46

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
SCHEMBL28951504 1.00 CTSL (0.60) CTSLCTSBCAPN1CTSSCTSK
SCHEMBL28951498 1.00 CTSL (0.60) CTSLCTSBCAPN1CTSSCTSK
SCHEMBL19668580 0.90 CTSL (0.73) CTSLCTSBCAPN1CTSSCTSK
SCHEMBL25539763 0.89 CTSL (0.62) CTSLCTSBCAPN1CTSSCTSK
SCHEMBL19668598 0.89 CTSL (0.60) CTSLCTSBCAPN1CTSSCTSK
SCHEMBL28951397 0.89 CTSL (0.53) CTSLCTSBCAPN1CTSSCTSK
SCHEMBL25525515 0.89 CTSL (0.53) CTSLCTSBCAPN1CTSSCTSK
SCHEMBL30174659 0.89 CTSL (0.53) CTSLCTSBCAPN1CTSSCTSK
SCHEMBL30174594 0.89 CTSL (0.50) CTSLCTSBCAPN1
SCHEMBL25547228 0.89 CTSL (0.50) CTSLCTSBCAPN1

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-115698035-A Inhibitors of norovirus and coronavirus replication 共晶制药公司 2023-02-03 CN disclosed