SCHEMBL28020770

SCHEMBL28020770

N#Cc1cccc(CF)n1

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CTSS P25774 2/20 0.40
SOS2 Q07890 1/20 0.39
CTSK P43235 1/20 0.38
IRAK4 Q9NWZ3 1/20 0.35
ALOX5AP P20292 2/20 0.34
FEN1 P39748 2/20 0.34
NPY5R Q15761 1/20 0.33
KCNH2 Q12809 1/20 0.33

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
SCHEMBL2954219 0.79 HSD11B1 (0.41) CTSSSOS2CTSKIRAK4KCNH2
SCHEMBL29561378 0.79 SOS2 (0.39) CTSSSOS2CTSKIRAK4ALOX5AP
SCHEMBL29413281 0.79 CCR1 (0.40) CTSSSOS2CTSKIRAK4ALOX5AP
SCHEMBL14732983 0.79 KCNH2 (0.44) CTSSSOS2CTSKIRAK4KCNH2
SCHEMBL1758823 0.79 SOS2 (0.43) CTSSSOS2CTSK
SCHEMBL9297038 0.79 SOS2 (0.39) CTSSSOS2CTSKIRAK4ALOX5AP
SCHEMBL378968 0.79 CCR1 (0.40) CTSSSOS2CTSKIRAK4ALOX5AP
SCHEMBL129485 0.79 SOS2 (0.39) CTSSSOS2CTSKIRAK4ALOX5AP
SCHEMBL3760158 0.79 IRAK4 (0.49) CTSSSOS2CTSKIRAK4ALOX5AP
SCHEMBL3354041 0.79 KCNH2 (0.33) KCNH2

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
CN-117736134-A Compounds and methods for enhancing degradation of target proteins and other polypeptides by E3 ubiquitin ligases 耶鲁大学 2024-03-22 CN disclosed
CN-104736569-A Compounds and methods for enhancing degradation of target proteins and other polypeptides by E3 ubiquitin ligase UNIV YALE 2015-06-24 CN disclosed