SCHEMBL727269

SCHEMBL727269

CC(C)(C)N[Ti](C)(C)C1C=C(N2CCCC2)c2ccccc21.[SiH4]

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
DRD2 P14416 1/20 0.33
DRD4 P21917 1/20 0.33
APAF1 O14727 1/20 0.31
TDP2 O95551 1/20 0.31
NSD2 O96028 1/20 0.31
HKDC1 Q2TB90 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
SCHEMBL5675677 0.94 ALDH1A1 (0.30) ALDH1A1MAPTDRD2DRD4
Butadiene SCHEMBL5675629 0.94 ALDH1A1 (0.30) ALDH1A1MAPTDRD2DRD4
SCHEMBL906450 0.89
SCHEMBL6066244 0.82
SCHEMBL6468553 0.76 CYP2C19 (0.40) ALDH1A1MAPTDRD2
Hydrochloric Acid SCHEMBL6388088 0.71 DRD2 (0.32) ALDH1A1MAPTDRD2DRD4APAF1
SCHEMBL6749148 0.70 DRD2 (0.33) ALDH1A1MAPTDRD2DRD4APAF1
SCHEMBL7775211 0.70 EEF2K (0.32)
SCHEMBL23982311 0.70 DRD2 (0.44) ALDH1A1MAPTDRD2DRD4APAF1
SCHEMBL5679143 0.69 DRD2 (0.33) ALDH1A1MAPTDRD2DRD4APAF1

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 50 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-4817209-B2 2011-11-16 JP claimed
JP-4722287-B2 2011-07-13 JP claimed
EP-1105397-A1 THREE COORDINATE ALUMINUM CATALYST ACTIVATOR COMPOSITION THE DOW CHEMICAL COMPANY (US) 2001-06-13 EP claimed
EP-1105398-A1 ACTIVATOR COMPOSITION COMPRISING ALUMINUM COMPOUND MIXTURE THE DOW CHEMICAL COMPANY (US) 2001-06-13 EP claimed
EP-1104426-A1 CATALYST ACTIVATOR COMPOSITION THE DOW CHEMICAL COMPANY (US) 2001-06-06 EP claimed
EP-1056752-A1 CATALYST ACTIVATORS COMPRISING EXPANDED ANIONS THE DOW CHEMICAL COMPANY (US) 2000-12-06 EP claimed
WO-2000011006-A1 METALLOID SALT CATALYST/ACTIVATORS THE DOW CHEMICAL COMPANY (US) 2000-03-02 WO claimed
WO-2000009514-A1 ACTIVATOR COMPOSITION COMPRISING ALUMINUM COMPOUND MIXTURE THE DOW CHEMICAL COMPANY (US) 2000-02-24 WO claimed
WO-2000009515-A1 CATALYST ACTIVATOR COMPOSITION THE DOW CHEMICAL COMPANY (US) 2000-02-24 WO claimed
WO-2000009513-A1 THREE COORDINATE ALUMINUM CATALYST ACTIVATOR COMPOSITION THE DOW CHEMICAL COMPANY (US) 2000-02-24 WO claimed
WO-1999042467-A1 CATALYST ACTIVATORS COMPRISING EXPANDED ANIONS THE DOW CHEMICAL COMPANY (US) 1999-08-26 WO claimed
EP-1509552-A1 SOLID, PARTICULATED, SPRAY DRIED, HETEROGENOUS CATALYST COMPOSITION Univation Technologies LLC (US) 2005-03-02 EP disclosed
WO-2004048388-A1 TRIPHENYLCARBENIUM SALTS OF GROUP 13 FLUOROARYL COMPLEXES DOW GLOBAL TECHNOLOGIES, INC. (US) 2004-06-10 WO disclosed
EP-1412365-A1 SALT OF LEWIS ACID/ACID ADDUCTS AND CATALYST ACTIVATORS THEREFROM DOW GLOBAL TECHNOLOGIES INC. (US) 2004-04-28 EP disclosed
US-6727329-B2 USEFUL IN SOLUTION, GAS PHASE, SLURRY AND CATIONIC POLYMERIZATION OF OLEFINS DOW GLOBAL TECHNOLOGY INC. 2004-04-27 US disclosed
WO-2000009514-A1 ACTIVATOR COMPOSITION COMPRISING ALUMINUM COMPOUND MIXTURE THE DOW CHEMICAL COMPANY (US) 2000-02-24 WO disclosed
WO-2000009515-A1 CATALYST ACTIVATOR COMPOSITION THE DOW CHEMICAL COMPANY (US) 2000-02-24 WO disclosed
WO-2000009513-A1 THREE COORDINATE ALUMINUM CATALYST ACTIVATOR COMPOSITION THE DOW CHEMICAL COMPANY (US) 2000-02-24 WO disclosed
WO-1999042467-A1 CATALYST ACTIVATORS COMPRISING EXPANDED ANIONS THE DOW CHEMICAL COMPANY (US) 1999-08-26 WO disclosed
WO-1999015534-A1 MODIFIED ALUMOXANE CATALYST ACTIVATOR THE DOW CHEMICAL COMPANY (US) 1999-04-01 WO disclosed