SCHEMBL28529209

SCHEMBL28529209

COc1cc(C2(c3ccc(O)cc3)c3ccccc3-c3ccccc32)ccc1O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.57
ESR2 Q92731 1/20 0.57
MAOB P27338 1/20 0.49
KMT2A Q03164 3/20 0.46
MAPT P10636 3/20 0.46
KDM4E B2RXH2 3/20 0.46
MEN1 O00255 2/20 0.46
LMNA P02545 1/20 0.46
OPRK1 P41145 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
HPGD P15428 3/20 0.43
GAA P10253 2/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
ALDH1A1 P00352 3/20 0.41
PDE4D Q08499 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
TP53 P04637 1/20 0.40
TSHR P16473 1/20 0.40
PDK2 Q15119 1/20 0.39

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
SCHEMBL29967843 0.94 ESR1 (0.64) ESR1ESR2MAOBKMT2AMAPT
SCHEMBL217607 0.94 ESR1 (0.64) ESR1ESR2MAOBKMT2AMAPT
SCHEMBL22738262 0.82 ESR1 (0.63) ESR1ESR2KMT2AMAPTKDM4E
SCHEMBL6208231 0.81 ESR1 (0.88) ESR1ESR2KMT2AMAPTKDM4E
SCHEMBL17399575 0.81 ESR1 (0.88) ESR1ESR2KMT2AMAPTKDM4E
SCHEMBL29462973 0.80 PDE4D (0.53) ESR1ESR2KMT2AMAPTKDM4E
SCHEMBL649109 0.80 PDE4D (0.53) ESR1ESR2KMT2AMAPTKDM4E
SCHEMBL9229705 0.80 ESR1 (0.50) ESR1ESR2KMT2AMAPTKDM4E
SCHEMBL16674125 0.80 ESR1 (0.51) ESR1ESR2KMT2AMAPTKDM4E
SCHEMBL45826 0.79 MEN1 (0.63) ESR1ESR2KMT2AMAPTKDM4E

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-112213919-A Composition for forming organic film, method for forming pattern, and polymer 信越化学工业株式会社 2021-01-12 CN disclosed