SCHEMBL29358860

SCHEMBL29358860

CC(C)(C)OC(=O)NC(Cc1ccccc1)C(=O)NCc1cccc(Cl)c1F

nearest known ligand 0.61

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CTSS P25774 14/20 0.61
▸ CTSK P43235 13/20 0.61
▸ CTSB P07858 4/20 0.61
▸ CTSL P07711 2/20 0.61
▸ AKT1 P31749 1/20 0.54
▸ CYP3A4 P08684 1/20 0.49
▸ SCN9A Q15858 1/20 0.49
▸ SCN10A Q9Y5Y9 1/20 0.49
▸ ACE P12821 1/20 0.48

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
SCHEMBL29781555 1.00 CTSS (0.61) CTSSCTSKCTSBCTSLAKT1
SCHEMBL19236869 1.00 CTSS (0.61) CTSSCTSKCTSBCTSLAKT1
SCHEMBL28803148 1.00 CTSS (0.61) CTSSCTSKCTSBCTSLAKT1
SCHEMBL19236710 0.88 CFD (0.52) CTSSCTSKCTSBCTSLCYP3A4
SCHEMBL30146876 0.88 CFD (0.52) CTSSCTSKCTSBCTSLCYP3A4
SCHEMBL19236696 0.87 CTSS (0.48) CTSSCTSKCTSBCTSLCYP3A4
SCHEMBL28803175 0.87 CTSS (0.48) CTSSCTSKCTSBCTSLCYP3A4
SCHEMBL29781803 0.87 CTSS (0.48) CTSSCTSKCTSBCTSLCYP3A4
SCHEMBL19236859 0.86 CTSS (0.51) CTSSCTSKCTSBCTSL
SCHEMBL30146896 0.86 CTSS (0.51) CTSSCTSKCTSBCTSL

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
EP-3411411-B3 1H-INDAZOLE-3-CARBOXAMIDE DERIVATIVES AND RELATED COMPOUNDS AS FACTOR D INHIBITORS FOR TREATING DISEASES CHARACTERIZED BY ABERRANT COMPLEMENT SYSTEM ACTIVITY, SUCH AS E.G. IMMUNOLOGICAL DISORDERS BIOCRYST PHARM INC (US) 2022-01-26 — — EP disclosed
Send feedback