SCHEMBL30174299

SCHEMBL30174299

Cc1ccc(-c2c(C)ncc(C(N)=O)c2O)s1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.36
KMT2A Q03164 1/20 0.36
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
HPGD P15428 1/20 0.35
UBE2I P63279 1/20 0.35
SAE1 Q9UBE0 1/20 0.35
UBA2 Q9UBT2 1/20 0.35
JAK2 O60674 2/20 0.35
IKBKE Q14164 1/20 0.35
TBK1 Q9UHD2 1/20 0.35
SYK P43405 1/20 0.35
SIRT3 Q9NTG7 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
NNMT P40261 3/20 0.35
MAP4K4 O95819 1/20 0.33
MKNK1 Q9BUB5 1/20 0.33
MKNK2 Q9HBH9 1/20 0.33
ATF1 P18846 1/20 0.33
NFKB1 P19838 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
SCHEMBL28966254 0.80 NEK2 (0.43) KDM4EALDH1A1HPGDSYK
SCHEMBL30174243 0.79 CHEK1 (0.39) KDM4EKMT2ASIRT3TDP1NNMT
SCHEMBL30174264 0.77 NNMT (0.39) KDM4EKMT2ASYKNNMTHPGDS
SCHEMBL30174259 0.77 ALDH1A1 (0.38) KDM4EKMT2AALDH1A1SMN1; SMN2CYP2C9
SCHEMBL30174194 0.75 CHEK2 (0.45) KDM4EALDH1A1
SCHEMBL29812284 0.75 LMNA (0.44) KMT2ALMNAJAK2TDP1MAP4K4
SCHEMBL30174207 0.75 KMT2A (0.40) KDM4EKMT2AALDH1A1HPGDIKBKE
SCHEMBL30174265 0.74 CYP2A6 (0.43) KMT2AALDH1A1HPGDSIRT3TDP1
Hydrochloric Acid SCHEMBL29812079 0.73 LMNA (0.44) KMT2ALMNAJAK2TDP1MAP4K4
SCHEMBL30174294 0.72 CHEK2 (0.40) KMT2AALDH1A1SYKSIRT3TDP1

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-115605478-A Compounds and methods of use 埃克塞里艾克西斯公司(US) 2023-01-13 CN disclosed