SCHEMBL7061981

SCHEMBL7061981

C[Zr](c1ccccc1)(c1ccccc1)(C1C=Cc2ccccc21)C1C=Cc2ccccc21

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 6/20 0.34
HTR2A P28223 2/20 0.33
HTR6 P50406 1/20 0.33
KDM4E B2RXH2 2/20 0.31
BRD4 O60885 1/20 0.31
CCL2 P13500 1/20 0.31
LMNA P02545 1/20 0.31
TP53 P04637 1/20 0.31
CHRM2 P08172 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2D6 P10635 1/20 0.31
CHRM1 P11229 1/20 0.31
DRD2 P14416 1/20 0.31
ADRA2B P18089 1/20 0.31
ADRA2C P18825 1/20 0.31
NFKB1 P19838 1/20 0.31
CHRM3 P20309 1/20 0.31
SLC6A2 P23975 1/20 0.31
HTR2C P28335 1/20 0.31
ADRA1A P35348 1/20 0.31

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
SCHEMBL7066166 0.98 SIGMAR1 (0.33) SIGMAR1HTR2AHTR6KDM4EBRD4
Hydrochloric Acid SCHEMBL7065674 0.98 SIGMAR1 (0.33) SIGMAR1HTR2AHTR6KDM4EBRD4
Bromide SCHEMBL7064187 0.98 SIGMAR1 (0.33) SIGMAR1HTR2AHTR6KDM4EBRD4
Hydrochloric Acid SCHEMBL7066628 0.96 SIGMAR1 (0.33) SIGMAR1HTR2AHTR6KDM4EMEN1
Hydrochloric Acid SCHEMBL7066630 0.96 SIGMAR1 (0.33) SIGMAR1HTR2AHTR6
Methyl Alcohol SCHEMBL7062086 0.96 SIGMAR1 (0.33) SIGMAR1HTR2AHTR6
Bromide SCHEMBL7065912 0.96 SIGMAR1 (0.33) SIGMAR1HTR2AHTR6KDM4EMEN1
Methyl Alcohol SCHEMBL7062236 0.95 SIGMAR1 (0.32) SIGMAR1HTR2AHTR6KDM4EMEN1
SCHEMBL6831898 0.82 SIGMAR1 (0.33) SIGMAR1HTR2AHTR6
Hydrochloric Acid SCHEMBL443808 0.81 SIGMAR1 (0.32) SIGMAR1HTR2AHTR6KDM4EMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106674400-B The ethylene copolymer of excellent in workability 韩华道达尔有限公司 2019-11-29 CN disclosed
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