SCHEMBL8906127

SCHEMBL8906127

[Zr]C1c2ccccc2-c2cccc(C3C=Cc4ccccc43)c21

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 1/20 0.31
HTR2A P28223 1/20 0.31
CYP2D6 P10635 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
SCHEMBL7065767 0.92
SCHEMBL8906322 0.82 SIGMAR1 (0.31) HTR6HTR2ACYP2D6
SCHEMBL29386036 0.82 HTR2A (0.39) HTR6HTR2ACYP2D6
SCHEMBL19630560 0.82 HTR2A (0.39) HTR6HTR2ACYP2D6
Hydrochloric Acid SCHEMBL2483244 0.81
Hydrochloric Acid SCHEMBL8906221 0.81
Hydrochloric Acid SCHEMBL3355089 0.81
SCHEMBL8415237 0.79 GPR3 (0.31)
SCHEMBL7545630 0.78
Hydrochloric Acid SCHEMBL30769631 0.78 HTR2A (0.36) HTR6HTR2ACYP2D6

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
US-5646083-A Process for the preparation of a bridged metallocene compound as well as a catalyst component and a process for the polymerization of olefins DSM N.V. (NL) 1997-07-08 US disclosed