SCHEMBL28404201

SCHEMBL28404201

CC(C)(C)c1cc(-c2cccc3c2-c2ccccc2C3)ccc1OCCO

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 1/20 0.41
RARG P13631 10/20 0.40
RARA P10276 9/20 0.40
RARB P10826 9/20 0.40
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
SLC6A9 P48067 1/20 0.37
THRA P10827 1/20 0.34
THRB P10828 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C19 P33261 1/20 0.34
HSD17B10 Q99714 1/20 0.34
ALOX5AP P20292 1/20 0.34
FEN1 P39748 1/20 0.34
KCNH2 Q12809 1/20 0.33
TMEM97 Q5BJF2 1/20 0.33
SIGMAR1 Q99720 1/20 0.33
CTSS P25774 1/20 0.33
CTSK P43235 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
SCHEMBL28909633 0.93 RARG (0.43) ARRARGRARARARBKDM4E
Fluorene SCHEMBL28408646 0.87 AR (0.42) ARRARGRARARARBKDM4E
SCHEMBL577662 0.86 AR (0.43) ARRARGRARARARBKDM4E
SCHEMBL28909635 0.77 RARA (0.33) ARRARGRARARARBKDM4E
SCHEMBL28856359 0.77 LMNA (0.44) ARKDM4EALDH1A1ALOX5APFEN1
SCHEMBL30110485 0.77 LMNA (0.44) ARKDM4EALDH1A1ALOX5APFEN1
SCHEMBL31388247 0.75 LMNA (0.39) KDM4EALDH1A1MEN1KMT2A
SCHEMBL577075 0.74 AR (0.35) ARRARGRARARARBKDM4E
SCHEMBL28525858 0.72 USP2 (0.36) KDM4EALDH1A1SLC6A9MEN1KMT2A
SCHEMBL21462986 0.71 SLC6A9 (0.43) ARRARGRARARARBKDM4E

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-111205448-B Method for preparing polycarbonate by catalysis 中国科学院过程工程研究所 2021-07-02 CN claimed
CN-111205448-A Method for preparing polycarbonate by catalysis 中国科学院过程工程研究所 2020-05-29 CN claimed
CN-111205448-B Method for preparing polycarbonate by catalysis 中国科学院过程工程研究所 2021-07-02 CN disclosed
CN-111205448-A Method for preparing polycarbonate by catalysis 中国科学院过程工程研究所 2020-05-29 CN disclosed