SCHEMBL7182142

SCHEMBL7182142

Cl[Ti](Cc1ccccc1)(Cc1ccccc1)C1C=Cc2ccccc21

nearest known ligand 0.38

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 6/20 0.38
HTR6 P50406 1/20 0.37
HTR2A P28223 1/20 0.34

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
SCHEMBL5888557 0.83 SIGMAR1 (0.39) SIGMAR1HTR6HTR2A
SCHEMBL30596224 0.83 SIGMAR1 (0.39) SIGMAR1HTR6HTR2A
SCHEMBL7754820 0.83 SIGMAR1 (0.39) SIGMAR1HTR6HTR2A
Hydrochloric Acid SCHEMBL4461335 0.79 SIGMAR1 (0.40) SIGMAR1HTR6HTR2A
SCHEMBL395683 0.76 HTR2A (0.38) SIGMAR1HTR6HTR2A
SCHEMBL1929586 0.76 HTR2A (0.38) SIGMAR1HTR6HTR2A
Ethylene SCHEMBL9409610 0.73 HTR2A (0.35) HTR6HTR2A
SCHEMBL4461223 0.70 HTR6 (0.31) HTR6HTR2A
SCHEMBL28734965 0.70 HTR6 (0.31) HTR6HTR2A
SCHEMBL31000042 0.69 HTR2A (0.35) SIGMAR1HTR6HTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0502683-B2 Catalyst composition for preparation of syndiotactic vinyl aromatic polymers DOW CHEMICAL CO (US) 2003-04-02 EP disclosed
US-5886117-A Process using borane derived catalysts for preparation of syndiotactic vinyl aromatic polymers THE DOW CHEMICAL COMPANY (US) 1999-03-23 US disclosed
EP-0742226-B1 Process for preparing borane derived catalysts for preparation of syndiotactic vinyl aromatic polymers DOW CHEMICAL CO (US) 1998-12-02 EP disclosed
EP-0742226-A2 Process for preparing borane derived catalysts for preparation of syndiotactic vinyl aromatic polymers THE DOW CHEMICAL COMPANY (US) 1996-11-13 EP disclosed
EP-0502683-B1 Catalyst composition for preparation of syndiotactic vinyl aromatic polymers DOW CHEMICAL CO (US) 1996-07-17 EP disclosed
EP-0421659-B1 Process for preparation of syndiotactic vinyl aromatic polymers DOW CHEMICAL CO (US) 1996-07-10 EP disclosed
US-5206197-A CATALYST COMPOSITION FOR PREPARATION OF SYNDIOTACTIC VINYL AROMATIC POLYMERS THE DOW CHEMICAL COMPANY (US) 1993-04-27 US disclosed
EP-0502683-A1 Catalyst composition for preparation of syndiotactic vinyl aromatic polymers THE DOW CHEMICAL COMPANY (US) 1992-09-09 EP disclosed
US-5066741-A Contacting monomers with complex catalyst THE DOW CHEMICAL COMPANY (US) 1991-11-19 US disclosed
EP-0421659-A2 Process for preparation of syndiotactic vinyl aromatic polymers THE DOW CHEMICAL COMPANY (US) 1991-04-10 EP disclosed