SCHEMBL28093206

SCHEMBL28093206

C=CC(=O)OCc1cccc2c1C(C)c1ccccc1-2

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 2/20 0.38
THRA P10827 1/20 0.35
POLB P06746 1/20 0.35
FABP7 O15540 1/20 0.34
FABP3 P05413 1/20 0.34
FABP5 Q01469 1/20 0.34
EPHX2 P34913 1/20 0.33
KMT2A Q03164 1/20 0.33
EPHX1 P07099 2/20 0.32
HTR7 P34969 1/20 0.32
HTR2B P41595 1/20 0.32
CYP2D6 P10635 2/20 0.32
TYR P14679 1/20 0.32
TSHR P16473 3/20 0.31
CYP1A2 P05177 2/20 0.31
CYP2C19 P33261 2/20 0.31
PPARG P37231 1/20 0.31
HPGD P15428 3/20 0.31
KDM4E B2RXH2 1/20 0.31
LMNA P02545 1/20 0.31

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
SCHEMBL4839883 0.83 EPHX2 (0.43) THRBTHRAFABP7FABP5EPHX2
SCHEMBL27971783 0.78 THRB (0.42) THRBTHRAPOLBFABP3KMT2A
SCHEMBL29577996 0.76 THRB (0.53) THRBTHRATSHRPPARGHPGD
SCHEMBL10451653 0.76 THRB (0.53) THRBTHRATSHRPPARGHPGD
SCHEMBL11570150 0.75 AKR1B1 (0.44) POLBTSHRCYP1A2CYP2C19HPGD
SCHEMBL1371361 0.74 THRB (0.47) THRBTHRATSHRHPGDLMNA
SCHEMBL13975601 0.73 CD274 (0.54) EPHX1
SCHEMBL8692638 0.73 THRB (0.47) THRBFABP7FABP3FABP5KMT2A
SCHEMBL1591973 0.72 MAOB (0.46) THRBTHRAKMT2ATSHRHPGD
SCHEMBL27421526 0.72 THRB (0.45) THRBTHRAKMT2AEPHX1TSHR

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-103890018-B Polyfunctional (meth) acrylate having fluorene skeleton and curable composition thereof 大阪燃气化学有限公司 2016-08-17 CN disclosed