SCHEMBL9420191

SCHEMBL9420191

CC(C)(C)c1ccc([Mg]c2ccc(C(C)(C)C)cc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.52
LMNA P02545 1/20 0.50
TYR P14679 1/20 0.50
KIF11 P52732 2/20 0.42
ALDH1A1 P00352 4/20 0.41
HPGD P15428 2/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
MAPT P10636 1/20 0.39
MAPK1 P28482 1/20 0.39
HDAC1 Q13547 1/20 0.39
SLC22A2 O15244 1/20 0.39
SLC22A1 O15245 1/20 0.39
SLC22A3 O75751 1/20 0.39
BCHE P06276 4/20 0.39
ACHE P22303 4/20 0.39
ALOX15 P16050 1/20 0.39
HSD17B10 Q99714 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
SRD5A2 P31213 1/20 0.38

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
SCHEMBL424728 0.80 TSHR (0.73) TSHRLMNATYRKIF11ALDH1A1
SCHEMBL1897181 0.78 TSHR (0.48) TSHRLMNATYRKIF11ALDH1A1
SCHEMBL663624 0.78 TSHR (0.48) TSHRLMNATYRKIF11ALDH1A1
Bromide SCHEMBL2959626 0.76 TSHR (0.46) TSHRLMNATYRKIF11ALDH1A1
SCHEMBL26915 0.71 KIF11 (0.70) TSHRLMNATYRKIF11ALDH1A1
SCHEMBL1538330 0.71 TSHR (0.61) TSHRLMNATYRKIF11ALDH1A1
SCHEMBL3423876 0.71 KIF11 (0.70) TSHRLMNATYRKIF11ALDH1A1
SCHEMBL17923896 0.71 TSHR (0.61) TSHRLMNATYRKIF11ALDH1A1
SCHEMBL11240156 0.71 TSHR (0.52) TSHRLMNATYRKIF11ALDH1A1
SCHEMBL1931781 0.69 KIF11 (0.67) TSHRLMNATYRKIF11ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0014338-B1 CATALYST, CATALYST COMPONENT AND PROCESS FOR THE POLYMERIZATION OF OLEFINS PHILLIPS PETROLEUM COMPANY (US) 1983-09-28 EP claimed
US-4235746-A MAGNESIUM-TITANIUM COORDINATION CATALYST PHILLIPS PETROLEUM COMPANY (US) 1980-11-25 US claimed
EP-0014338-A1 Catalyst, catalyst component and process for the polymerization of olefins PHILLIPS PETROLEUM COMPANY (US) 1980-08-20 EP claimed
US-5350724-A Polyolefin polymerization process, process of producing catalyst, and catalyst PHILLIPS PETROLEUM COMPANY (US) 1994-09-27 US disclosed
US-4843133-A SILICA-SUPPORTED COORDINATION CATALYST PHILLIPS PETROLEUM COMPANY (US) 1989-06-27 US disclosed
US-4565795-A TITANIUM, DIHYDROCARBYL MAGNESIUM, SILICA COORDINATION CATALYST PHILLIPS PETROLEUM COMPANY (US) 1986-01-21 US disclosed
US-4560733-A COORDINATION CATALYSTS OF DIHYDROCARBYLMAGNESIUM, ORGANOALUMINUM COMPOUND AND TITANIUM HALIDE PHILLIPS PETROLEUM COMPANY (US) 1985-12-24 US disclosed
US-4540757-A TITANIUM, ALUMINUM, MAGNESIUM AND SILANE COMPONENTS; ETHYLENE POLYMERS PHILLIPS PETROLEUM COMPANY (US) 1985-09-10 US disclosed
US-4472523-A COMPLEX WITH HYDROCARBYL MAGNESIUM PHILLIPS PETROLEUM COMPANY (US) 1984-09-18 US disclosed
EP-0014338-B1 CATALYST, CATALYST COMPONENT AND PROCESS FOR THE POLYMERIZATION OF OLEFINS PHILLIPS PETROLEUM COMPANY (US) 1983-09-28 EP disclosed
US-4396747-A COORDINATION CATALYSTS PHILLIPS PETROLEUM COMPANY (US) 1983-08-02 US disclosed
US-4235746-A MAGNESIUM-TITANIUM COORDINATION CATALYST PHILLIPS PETROLEUM COMPANY (US) 1980-11-25 US disclosed
EP-0014338-A1 Catalyst, catalyst component and process for the polymerization of olefins PHILLIPS PETROLEUM COMPANY (US) 1980-08-20 EP disclosed