SCHEMBL25823740

SCHEMBL25823740

CC(=O)CCc1cn(C(C)(C)C)c(=O)[nH]c1=O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DAO P14920 2/20 0.37
KDM4E B2RXH2 2/20 0.36
LMNA P02545 2/20 0.36
RECQL P46063 1/20 0.36
POLB P06746 1/20 0.36
HPGD P15428 1/20 0.36
TSHR P16473 1/20 0.36
IAPP P10997 1/20 0.35
CYP2C9 P11712 2/20 0.35
KMT2A Q03164 2/20 0.35
MAPT P10636 1/20 0.35
HTT P42858 1/20 0.33
ALDH1A1 P00352 2/20 0.33
CYP1A2 P05177 3/20 0.32
CYP2C19 P33261 3/20 0.32
GAA P10253 1/20 0.32
MEN1 O00255 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
TK2 O00142 1/20 0.32
TK1 P04183 1/20 0.32

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
SCHEMBL18871232 0.78 GRIA1 (0.38) DAOLMNAPOLBCYP2C9KMT2A
SCHEMBL25823753 0.78 TK1 (0.40) DAOKDM4EHPGDCYP2C9KMT2A
SCHEMBL27057530 0.77 KDM4E (0.44) KDM4ELMNACYP2C9KMT2AMAPT
SCHEMBL21283135 0.75 MAPK1 (0.33) DAOTDP1TK1
SCHEMBL24420455 0.69 DAO (0.40) DAOHPGDTSHRCYP2C9KMT2A
SCHEMBL25824402 0.68 KMT2A (0.36) KDM4ECYP2C9KMT2AMAPTHTT
SCHEMBL20966271 0.67 HTT (0.43) KDM4ERECQLHTTGAA
SCHEMBL6882444 0.67 PYGM (0.61) LMNAHPGDTSHRMAPTTK2
SCHEMBL13447776 0.67 PYGM (0.61) LMNAHPGDTSHRMAPTTK2
SCHEMBL9910660 0.66 MAPK1 (0.44) LMNAPOLBHPGDALDH1A1TK2

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
US-20240026358-A1 OLIGONUCLEOTIDE COMPOSITIONS AND METHODS THEREOF WAVE LIFE SCIENCES LTD. (SG) 2024-01-25 US disclosed
US-20230220384-A1 OLIGONUCLEOTIDE COMPOSITIONS AND METHODS OF USE THEREOF WAVE LIFE SCIENCES LTD. (SG) 2023-07-13 US disclosed