SCHEMBL21179138

SCHEMBL21179138

CN(CCC(CSc1ccccc1)NC(=O)OC(C)(C)C)C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.44
CTSK P43235 6/20 0.42
PPARG P37231 3/20 0.42
PPARA Q07869 3/20 0.42
CTSS P25774 3/20 0.41
CTSL P07711 1/20 0.41
CTSB P07858 1/20 0.41
MTNR1A P48039 3/20 0.40
MTNR1B P49286 3/20 0.40
PPARD Q03181 2/20 0.40
MMP13 P45452 1/20 0.40
SYK P43405 1/20 0.39
JAK3 P52333 1/20 0.38
BTK Q06187 1/20 0.38
AKT1 P31749 1/20 0.38

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
SCHEMBL21539126 0.91 ATM (0.46) ATMCTSKPPARGPPARACTSS
SCHEMBL30404606 0.87 ATM (0.42) ATMCTSKPPARGPPARACTSS
SCHEMBL31282768 0.86 ATM (0.39) ATMCTSKPPARGPPARACTSS
SCHEMBL30405268 0.85 ATM (0.41) ATMCTSKPPARGPPARACTSS
SCHEMBL22409489 0.84 ATM (0.48) ATMCTSKPPARGPPARACTSS
SCHEMBL22203002 0.84 ATM (0.48) ATMCTSKPPARGPPARACTSS
SCHEMBL19014888 0.84 ATM (0.48) ATMCTSKPPARGPPARACTSS
SCHEMBL30405523 0.84 PPARA (0.41) ATMCTSKPPARGPPARACTSS
SCHEMBL2947311 0.83 PLA2G2A (0.48) ATMCTSKPPARGPPARACTSS
SCHEMBL30404588 0.83 ATM (0.41) ATMCTSKPPARGPPARACTSS

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3743069-A1 BCL-2 PROTEINS DEGRADERS FOR CANCER TREATMENT BioVentures, LLC (US) 2020-12-02 EP disclosed
WO-2019144117-A1 BCL-2 PROTEINS DEGRADERS FOR CANCER TREATMENT BIOVENTURES, LLC (US) 2019-07-25 WO disclosed