SCHEMBL28329520

SCHEMBL28329520

C=CC(=O)Oc1cc(C)ccc1C1(c2ccc(C)cc2OC(=O)C=C)CCc2ccccc21

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PIN1 Q13526 3/20 0.37
LMNA P02545 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
THRA P10827 1/20 0.34
THRB P10828 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
LPAR1 Q92633 5/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
HCAR2 Q8TDS4 1/20 0.33
CYP3A4 P08684 1/20 0.32
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
HTT P42858 1/20 0.32

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
SCHEMBL28303786 0.77 PDK2 (0.40) LMNAL3MBTL1THRATHRBNPSR1
SCHEMBL21829153 0.75 THRB (0.38) THRBHCAR2MAPT
SCHEMBL13346906 0.71 MEN1 (0.40) PIN1LMNAMEN1KMT2AHCAR2
SCHEMBL27464291 0.69 TSHR (0.46) LMNAL3MBTL1THRATHRBMAPT
SCHEMBL12611285 0.69 SIGMAR1 (0.38) LMNAHCAR2ALDH1A1
SCHEMBL27655931 0.67 LMNA (0.37) LMNAL3MBTL1THRATHRBKMT2A
SCHEMBL27655924 0.67 LMNA (0.39) LMNAL3MBTL1THRATHRBMAPT
SCHEMBL39759 0.67 KMT2A (0.47) LMNAL3MBTL1THRATHRBNPSR1
SCHEMBL30593911 0.66 L3MBTL1 (0.47) LMNAL3MBTL1THRATHRBNPSR1
SCHEMBL39820 0.66 L3MBTL1 (0.47) LMNAL3MBTL1THRATHRBNPSR1

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-110392864-A Negative light-sensitive resin combination, cured film, the element for having cured film and organic el display and its manufacturing method 东丽株式会社 2019-10-29 CN disclosed