SCHEMBL8384152

SCHEMBL8384152

COc1ccc(-c2ccccc2OC(C)C)c(C2OCC(C)(C)N2C)c1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.35
NPSR1 Q6W5P4 1/20 0.35
ADRA1D P25100 4/20 0.35
ADRA1A P35348 4/20 0.35
ADRA1B P35368 4/20 0.35
CYP19A1 P11511 1/20 0.33
ALDH1A1 P00352 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CYP2C19 P33261 2/20 0.33
DRD2 P14416 2/20 0.33
CYP1A2 P05177 1/20 0.32
CYP2C9 P11712 1/20 0.32
HTT P42858 1/20 0.32
PDE10A Q9Y233 1/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
GAA P10253 1/20 0.32
MAPK1 P28482 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
DNMT3B Q9UBC3 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
Iodide SCHEMBL7794834 0.99 MAPT (0.35) MAPTNPSR1ADRA1DADRA1AADRA1B
SCHEMBL7792045 0.83 CYP1A1 (0.38) MAPTNPSR1ADRA1DADRA1AADRA1B
Iodide SCHEMBL7792211 0.82 CYP1A1 (0.38) MAPTNPSR1ADRA1DADRA1AADRA1B
SCHEMBL7794718 0.79 NPSR1 (0.36) NPSR1ADRA1DADRA1AADRA1BCYP19A1
Iodide SCHEMBL7794833 0.67 NPSR1 (0.36) MAPTNPSR1ADRA1DADRA1AADRA1B
SCHEMBL23747291 0.66 NPSR1 (0.48) MAPTNPSR1ADRA1DADRA1AADRA1B
SCHEMBL4836705 0.65 KMT2A (0.36) MEN1KMT2ATDP1
SCHEMBL7792695 0.64 SMN1; SMN2 (0.55) NPSR1ALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL3632568 0.63 IRAK4 (0.50) MAPTNPSR1ALDH1A1CYP2C19CYP1A2
SCHEMBL31634047 0.63 IRAK4 (0.50) MAPTNPSR1ALDH1A1CYP2C19CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0906268-A1 ALKYLOXYAMINO SUBSTITUTED FLUORENONES AND THEIR USE AS PROTEIN KINASE C INHIBITORS HOECHST MARION ROUSSEL, INC. (US) 1999-04-07 EP disclosed
WO-1997045397-A1 ALKYLOXYAMINO SUBSTITUTED FLUORENONES AND THEIR USE AS PROTEIN KINASE C INHIBITORS HOECHST MARION ROUSSEL, INC. (US) 1997-12-04 WO disclosed