SCHEMBL25219488

SCHEMBL25219488

CC(C)(C)OC(=O)NC(Cc1ccccc1C#N)C(=O)N1CC(F)(F)C1

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CTSS P25774 12/20 0.50
CTSK P43235 11/20 0.50
CTSL P07711 3/20 0.44
CTSB P07858 2/20 0.44
KMT2A Q03164 2/20 0.44
PTPN1 P18031 1/20 0.43
MC4R P32245 1/20 0.42
MAPK1 P28482 1/20 0.41
SCN9A Q15858 1/20 0.40

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
SCHEMBL3815064 0.82 CTSS (0.58) CTSSCTSKCTSLCTSBPTPN1
SCHEMBL29907919 0.81 CTSS (0.60) CTSSCTSKCTSLCTSBPTPN1
SCHEMBL3812341 0.81 CTSS (0.60) CTSSCTSKCTSLCTSBPTPN1
SCHEMBL17912348 0.81 CTSS (0.60) CTSSCTSKCTSLCTSBPTPN1
SCHEMBL29842925 0.81 CTSS (0.60) CTSSCTSKCTSLCTSBPTPN1
SCHEMBL3812344 0.81 CTSS (0.60) CTSSCTSKCTSLCTSBPTPN1
SCHEMBL25219069 0.75 DPP4 (0.56)
SCHEMBL4847806 0.74 PTPN1 (0.45) CTSSCTSKCTSLCTSBKMT2A
SCHEMBL30461860 0.73 MC4R (0.52) CTSSCTSKCTSLCTSBKMT2A
SCHEMBL5969521 0.72 PTPN1 (0.51) CTSSCTSKCTSLCTSBPTPN1

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-2023107597-A2 BICYCLIC HETEROAROMATIC AMIDE COMPOUNDS AND USES THEREOF Kineta, Inc. (US) 2023-06-15 WO disclosed