SCHEMBL19303812

SCHEMBL19303812

COc1cc(O)c2c(c1-c1c(OC)cc(O)c3c1C(=O)c1cc(C)cc(O)c1C3=O)C(=O)c1cc(C)cc(O)c1C2=O

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ELANE P08246 5/20 0.65
▸ ALDH1A1 P00352 4/20 0.65
▸ MAPT P10636 3/20 0.65
▸ ALOX15 P16050 2/20 0.65
▸ KDM4E B2RXH2 2/20 0.65
▸ GLA P06280 1/20 0.65
▸ HPGD P15428 1/20 0.65
▸ PIM1 P11309 4/20 0.64
▸ ACLY P53396 8/20 0.60
▸ CYP3A4 P08684 3/20 0.58
▸ MEN1 O00255 2/20 0.58
▸ TSHR P16473 2/20 0.58
▸ MAPK1 P28482 2/20 0.58
▸ KMT2A Q03164 2/20 0.58
▸ TDP1 Q9NUW8 2/20 0.58
▸ CYP1A2 P05177 2/20 0.58
▸ NPC1 O15118 1/20 0.58
▸ PTP4A3 O75365 1/20 0.58
▸ GMNN O75496 1/20 0.58
▸ LMNA P02545 1/20 0.58

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
SCHEMBL29709363 0.91 PIM1 (0.69) ELANEALDH1A1MAPTALOX15KDM4E
SCHEMBL23199095 0.86 ALDH1A1 (0.60) ELANEALDH1A1MAPTALOX15KDM4E
Skyrin SCHEMBL2665352 0.84 ACLY (0.75) ELANEALDH1A1MAPTALOX15KDM4E
Questin SCHEMBL15676283 0.84 ELANE (0.73) ELANEALDH1A1MAPTALOX15KDM4E
Questin SCHEMBL29359576 0.84 ELANE (0.73) ELANEALDH1A1MAPTALOX15KDM4E
SCHEMBL16227337 0.83 ELANE (0.83) ELANEALDH1A1MAPTALOX15KDM4E
1-O-Methylemodin SCHEMBL16225819 0.81 ELANE (0.73) ELANEALDH1A1MAPTALOX15KDM4E
SCHEMBL16226994 0.81 ELANE (0.66) ELANEALDH1A1MAPTALOX15KDM4E
SCHEMBL29359746 0.81 ELANE (0.66) ELANEALDH1A1MAPTALOX15KDM4E
SCHEMBL29361502 0.81 ELANE (0.66) ELANEALDH1A1MAPTALOX15KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3421449-B1 PRODUCTION METHOD FOR 1,1'-BINAPHTHYL DERIVATIVES UNIV KYOTO (JP) 2021-03-31 — — EP disclosed
EP-3421449-A1 PRODUCTION METHOD FOR 1,1'-BINAPHTHYL DERIVATIVE, AND 1,1'-BINAPHTHYL DERIVATIVE Kyoto University (JP) 2019-01-02 — — EP disclosed
WO-2017145716-A1 PRODUCTION METHOD FOR 1,1'-BINAPHTHYL DERIVATIVE, AND 1,1'-BINAPHTHYL DERIVATIVE 国立大学法人京都大学 2017-08-31 — — WO disclosed
Send feedback