SCHEMBL31290628

SCHEMBL31290628

CC(C)(C)OC(=O)N1CCCC1c1ccc(Br)cc1F

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 3/20 0.47
UCHL1 P09936 2/20 0.46
KMT2A Q03164 1/20 0.45
LMNA P02545 3/20 0.44
TSHR P16473 2/20 0.44
NR1H2 P55055 2/20 0.44
NR1H3 Q13133 1/20 0.44
RIPK1 Q13546 2/20 0.43
NPSR1 Q6W5P4 2/20 0.43
MAPT P10636 1/20 0.42
NPC1 O15118 1/20 0.42
ALDH1A1 P00352 2/20 0.41

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
SCHEMBL26987927 1.00 USP30 (0.47) USP30UCHL1KMT2ALMNATSHR
SCHEMBL17041234 0.88 RIPK1 (0.50) UCHL1LMNATSHRRIPK1NPSR1
SCHEMBL13740383 0.87 LMNA (0.48) USP30UCHL1KMT2ALMNATSHR
SCHEMBL31413078 0.86 ALDH1A1 (0.52) USP30UCHL1KMT2ALMNATSHR
SCHEMBL1922847 0.86 NR1H2 (0.46) UCHL1KMT2ALMNATSHRNR1H2
SCHEMBL2695856 0.86 NR1H2 (0.46) UCHL1KMT2ALMNATSHRNR1H2
SCHEMBL30545396 0.84 USP30 (0.43) USP30UCHL1KMT2ALMNATSHR
SCHEMBL16891482 0.84 LMNA (0.45) UCHL1KMT2ALMNATSHRRIPK1
SCHEMBL22820439 0.84 USP30 (0.46) USP30UCHL1KMT2ALMNATSHR
SCHEMBL13154983 0.83 KMT2A (0.45) USP30UCHL1KMT2ALMNATSHR

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
CN-119233976-A Modulators of c-MYC mRNA translation and their use in the treatment of cancer 艾尼莫生物科技公司 2024-12-31 CN disclosed