SCHEMBL28020116

SCHEMBL28020116

CCCCOc1ccccc1C(=O)OC(C)C

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.57
MAPT P10636 2/20 0.57
L3MBTL1 Q9Y468 2/20 0.57
CYP3A4 P08684 2/20 0.56
MEN1 O00255 1/20 0.56
NR1I2 O75469 1/20 0.56
CHRM2 P08172 1/20 0.56
ADRA2A P08913 1/20 0.56
OPRK1 P41145 1/20 0.56
HTR2B P41595 1/20 0.56
SLC6A3 Q01959 1/20 0.56
KMT2A Q03164 1/20 0.56
HDAC6 Q9UBN7 1/20 0.56
TSHR P16473 4/20 0.53
TDP1 Q9NUW8 1/20 0.53
ALDH1A1 P00352 5/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
KDM4E B2RXH2 2/20 0.50
ADRB2 P07550 1/20 0.50
ADRB1 P08588 1/20 0.50

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
SCHEMBL28020528 0.92 ADRB2 (0.57) LMNAMAPTL3MBTL1CYP3A4MEN1
SCHEMBL11985708 0.88 LMNA (0.54) LMNAMAPTL3MBTL1CYP3A4MEN1
SCHEMBL10324240 0.86 HCRTR1 (0.55) LMNAMAPTL3MBTL1MEN1KMT2A
SCHEMBL28026642 0.85 TSHR (0.54) LMNAMAPTL3MBTL1CYP3A4MEN1
SCHEMBL4833801 0.85 HTT (0.52) LMNAMAPTL3MBTL1CYP3A4MEN1
SCHEMBL11339323 0.84 KDM4E (0.52) LMNAMAPTL3MBTL1ALDH1A1SMN1; SMN2
SCHEMBL6462760 0.84 LMNA (0.62) LMNAMAPTL3MBTL1CYP3A4MEN1
SCHEMBL8724910 0.84 LMNA (0.67) LMNAMAPTL3MBTL1CYP3A4MEN1
SCHEMBL28811038 0.84 LMNA (0.62) LMNAMAPTL3MBTL1CYP3A4MEN1
SCHEMBL28761328 0.83 TSHR (0.78) LMNAL3MBTL1CYP3A4TSHRTDP1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104829756-B A kind of solid catalyst component for olefine polymerization and its preparation method and application 中国科学院化学研究所 2018-05-15 CN disclosed
CN-103819586-B A kind of catalyst system for olefinic polyreaction SINOPEC CORP. (CN) 2016-03-30 CN disclosed
CN-103304691-B A kind of catalyst system for olefinic polyreaction SINOPEC CORP. (CN) 2015-09-16 CN disclosed
CN-104829756-A Solid catalyst component for olefin polymerization, and preparation method and application thereof CHINESE ACAD INST CHEMISTRY 2015-08-12 CN disclosed