SCHEMBL9869771

SCHEMBL9869771

CCCCCCCCOc1ccc(-n2nc3ccccc3n2)c(O)c1C(C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.41
TLR8 Q9NR97 2/20 0.40
MEN1 O00255 2/20 0.37
MAPT P10636 2/20 0.37
KMT2A Q03164 2/20 0.37
NR1I2 O75469 1/20 0.37
LMNA P02545 1/20 0.37
CHRM2 P08172 1/20 0.37
CYP3A4 P08684 1/20 0.37
ADRA2A P08913 1/20 0.37
OPRK1 P41145 1/20 0.37
HTR2B P41595 1/20 0.37
SLC6A3 Q01959 1/20 0.37
HDAC6 Q9UBN7 1/20 0.37
POLB P06746 1/20 0.36
ESR1 P03372 2/20 0.36
NPC1 O15118 3/20 0.34
RAB9A P51151 3/20 0.34
ALDH1A1 P00352 2/20 0.34
CHUK O15111 1/20 0.34

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
SCHEMBL6706905 0.82 TLR8 (0.44) KDM4ETLR8MEN1MAPTKMT2A
SCHEMBL27644486 0.81 KDM4E (0.41) KDM4ETLR8MEN1MAPTKMT2A
SCHEMBL9408817 0.81 TLR8 (0.43) KDM4ETLR8MEN1MAPTKMT2A
SCHEMBL5921968 0.78 LMNA (0.43) KDM4ETLR8MEN1MAPTKMT2A
SCHEMBL6359660 0.76 NPC1 (0.39) KDM4ETLR8LMNAPOLBNPC1
SCHEMBL10879715 0.76 NPC1 (0.39) KDM4ETLR8LMNAPOLBNPC1
SCHEMBL11441445 0.76 NPC1 (0.39) KDM4ETLR8LMNAPOLBNPC1
SCHEMBL9403927 0.76 KDM4E (0.51) KDM4ETLR8MEN1MAPTKMT2A
SCHEMBL29041053 0.74 THRA (0.45) KDM4ETLR8MEN1MAPTKMT2A
SCHEMBL30507656 0.74 THRA (0.45) KDM4ETLR8MEN1MAPTKMT2A

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-113544126-B Hindered amine stabilizer mixtures 巴斯夫欧洲公司 2024-11-08 CN disclosed
US-5019614-A Stabilized polymers SHELL OIL COMPANY (US) 1991-05-28 US disclosed