SCHEMBL7066602

SCHEMBL7066602

c1ccc([SiH](c2ccccc2)[Zr](C2c3ccccc3-c3ccccc32)C2c3ccccc3-c3ccccc32)cc1

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GPR3 P46089 2/20 0.35
HTR2A P28223 1/20 0.35
HDAC3 O15379 1/20 0.35
HDAC4 P56524 1/20 0.35
HDAC7 Q8WUI4 1/20 0.35
HDAC8 Q9BY41 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35
HDAC9 Q9UKV0 1/20 0.35
HDAC5 Q9UQL6 1/20 0.35
NCOR2 Q9Y618 1/20 0.35
POLB P06746 2/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
ATM Q13315 1/20 0.32
CYP1A2 P05177 2/20 0.31
TSHR P16473 1/20 0.31
ALDH1A1 P00352 1/20 0.31
CYP2D6 P10635 1/20 0.31
MAPT P10636 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
SCHEMBL8159328 0.81 HTR2C (0.32) GPR3MEN1KMT2AATMALDH1A1
Hydrochloric Acid SCHEMBL8150444 0.80 HTR7 (0.32) GPR3MEN1KMT2AATMALDH1A1
SCHEMBL814191 0.76 GPR3 (0.41) GPR3HTR2AHDAC3HDAC4HDAC7
Hydrochloric Acid SCHEMBL906469 0.74 GPR3 (0.40) GPR3HTR2AHDAC3HDAC4HDAC7
Chloromethane SCHEMBL7037925 0.72 GPR3 (0.39) GPR3HTR2AHDAC3HDAC4HDAC7
SCHEMBL814437 0.70
SCHEMBL814141 0.70
SCHEMBL8679861 0.68 GPR3 (0.38) GPR3HTR2AHDAC3HDAC4HDAC7
SCHEMBL23532439 0.68 GPR3 (0.38) GPR3HTR2AHDAC3HDAC4HDAC7
SCHEMBL815060 0.67 HTR6 (0.33) HTR2AMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0530908-B2 Process for the preparation of a bridged metallocene compound as well as a catalyst component and a process for the polymerization of olefins DSM NV (NL) 2003-06-04 EP disclosed
EP-0530908-B1 Process for the preparation of a bridged metallocene compound as well as a catalyst component and a process for the polymerization of olefins DSM NV (NL) 1999-04-21 EP disclosed
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
EP-0530908-A1 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) 1993-03-10 EP disclosed