SCHEMBL30165876

SCHEMBL30165876

CC(C)(C)OC(=O)N1CCCC(F)C1c1ccc(N)cc1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.44
NPC1 O15118 1/20 0.42
UCHL1 P09936 1/20 0.42
LMNA P02545 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
ALOX5AP P20292 1/20 0.40
FEN1 P39748 1/20 0.40
HSD17B10 Q99714 1/20 0.39
ALDH1A1 P00352 1/20 0.39
RIPK1 Q13546 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
SCHEMBL30912588 0.83 RIPK1 (0.51) NR1H2NPC1UCHL1LMNANPSR1
SCHEMBL1791760 0.83 RIPK1 (0.51) NR1H2NPC1UCHL1LMNANPSR1
SCHEMBL17645281 0.83 RIPK1 (0.51) NR1H2NPC1UCHL1LMNANPSR1
SCHEMBL3248455 0.80 KLK7 (0.42) NR1H2NPC1UCHL1LMNANPSR1
SCHEMBL1991706 0.80 RIPK1 (0.47) NR1H2NPC1LMNANPSR1ALDH1A1
SCHEMBL28379319 0.78 MEN1 (0.43) NPC1UCHL1LMNANPSR1MEN1
SCHEMBL28097449 0.77 NR1H2 (0.45) NR1H2NPC1ALDH1A1
SCHEMBL8154541 0.77 MEN1 (0.43) NPC1UCHL1LMNANPSR1MEN1
SCHEMBL30165827 0.77 NR1H2 (0.43) NR1H2NPC1UCHL1ALDH1A1RIPK1
SCHEMBL29679825 0.75 GPR119 (0.47) NPC1UCHL1LMNANPSR1MEN1

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-115557933-B Bruton tyrosine kinase and mutant degradation agent, composition and application thereof 杭州和正医药有限公司 2024-08-16 CN disclosed
CN-115557933-A Bruton tyrosine kinase and mutant degradation agent, composition and application thereof 杭州和正医药有限公司 2023-01-03 CN disclosed