SCHEMBL4079006

SCHEMBL4079006

CC1=C(C)C([Zr](Cl)Cl)c2ccccc21

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GPR3 P46089 1/20 0.33
SLC22A2 O15244 1/20 0.31
SLC22A3 O75751 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
SCHEMBL21409581 0.82 GPR3 (0.34) GPR3
SCHEMBL3371499 0.78 GPR3 (0.41) GPR3SLC22A2SLC22A3
SCHEMBL8201868 0.77 ACHE (0.33) GPR3
SCHEMBL8202195 0.77 GPR3 (0.31) GPR3
Hydrochloric Acid SCHEMBL8383875 0.73 POLB (0.35) GPR3
Hydrochloric Acid SCHEMBL8382778 0.73 GPR3 (0.32) GPR3
SCHEMBL28372193 0.71 CYP1A2 (0.32)
SCHEMBL6905173 0.71 MEN1 (0.32) GPR3
SCHEMBL1941203 0.70 GPR3 (0.38) GPR3SLC22A2SLC22A3
Hydrochloric Acid SCHEMBL8384503 0.70 MEN1 (0.31) GPR3

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
WO-2009104782-A1 ETHYLENE HOMOPOLYMER SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-08-27 WO disclosed
WO-2009104783-A1 CATALYST COMPONENT FOR POLYMERIZATION OF ETHYLENE AND PROCESS FOR PRODUCING ETHYLENE POLYMER (2) SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-08-27 WO disclosed
WO-2009104785-A1 CATALYST COMPONENT FOR POLYMERIZATION OF ETHYLENE AND PROCESS FOR PRODUCING ETHYLENE POLYMER (1) SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-08-27 WO disclosed
EP-0754698-A2 An olefin polymerization catalyst and a process for preparing olefin polymer MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1997-01-22 EP disclosed
EP-0287666-A1 PROCESS FOR POLYMERIZING OLEFINS Mitsui Chemicals, Inc. (JP) 1988-10-26 EP disclosed