SCHEMBL27435573

SCHEMBL27435573

Cc1cc(F)ccc1O[Zr](Oc1ccc(F)cc1C)(C1C=CC=C1)C1C=CC=C1

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.34
CYP2C19 P33261 3/20 0.34
CYP2C9 P11712 3/20 0.34
SLC6A4 P31645 6/20 0.33
MRGPRX4 Q96LA9 1/20 0.33
SSTR4 P31391 1/20 0.33
SLC6A2 P23975 4/20 0.32
SLC6A3 Q01959 3/20 0.32
HRH1 P35367 1/20 0.32
CYP2D6 P10635 2/20 0.31
SCN8A Q9UQD0 1/20 0.31
SCN10A Q9Y5Y9 1/20 0.31
NOTUM Q6P988 1/20 0.30
THRB P10828 1/20 0.30
HTR2A P28223 1/20 0.30
KCNH2 Q12809 1/20 0.30

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
SCHEMBL27519446 0.83 HSPB1 (0.34) SLC6A4SLC6A2SLC6A3
SCHEMBL27566797 0.83 ACHE (0.35) CYP3A4
SCHEMBL28745871 0.81 IDO1 (0.37) SLC6A4MRGPRX4SLC6A2
SCHEMBL28745873 0.80 SLC6A2 (0.36) SLC6A4SLC6A2SLC6A3HRH1CYP2D6
SCHEMBL28745898 0.79 CA3 (0.32)
SCHEMBL27536849 0.79 TSHR (0.37) SLC6A4SLC6A2SLC6A3
SCHEMBL27545247 0.77
SCHEMBL27545445 0.74
SCHEMBL28745899 0.72 MAPT (0.40) CYP3A4CYP2C19CYP2C9CYP2D6
SCHEMBL27566795 0.72 TSHR (0.36) CYP2C9

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
CN-1128817-C Solid catalyst for olefin polymerization and process for producing olefin polymer using the same MARUZEN PETROCHEM CO LTD (JP) 2003-11-26 CN disclosed
CN-1259963-A Catalytic components for polymerization of olefins, catalyst and process for the polymerization MARUZEN PETROCHEM CO LTD (JP) 2000-07-12 CN disclosed