SCHEMBL8057462

SCHEMBL8057462

CC(C)(C)N[Ti+2](C)(C)C1C=Cc2ccccc21.CC(C)[O-].CC(C)[O-].[SiH4]

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 2/20 0.32

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
Hydrochloric Acid SCHEMBL717823 0.91 SIGMAR1 (0.31) SIGMAR1
SCHEMBL8586772 0.89 SIGMAR1 (0.32) SIGMAR1
SCHEMBL8056521 0.83 KDM4E (0.30)
SCHEMBL8057561 0.76 KDM4E (0.35) SIGMAR1
Hydrochloric Acid SCHEMBL1996030 0.71
Hydrochloric Acid SCHEMBL1538830 0.66 MEN1 (0.35)
SCHEMBL9158981 0.65 SIGMAR1 (0.35) SIGMAR1
Hydrochloric Acid SCHEMBL7646722 0.64
Hydrochloric Acid SCHEMBL6673442 0.64
Hydrochloric Acid SCHEMBL7647996 0.64

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0822937-B1 SYNTHESIS OF GROUP 4 METAL DIENE COMPLEXES DOW CHEMICAL CO (US) 2000-05-17 EP disclosed
EP-0741739-B1 SYNTHESIS OF CYCLOPENTADIENYL METAL COORDINATION COMPLEXES FROM METAL HYDROCARBYLOXIDES DOW CHEMICAL CO (US) 1998-10-28 EP disclosed
EP-0822937-A1 SYNTHESIS OF GROUP 4 METAL DIENE COMPLEXES THE DOW CHEMICAL COMPANY (US) 1998-02-11 EP disclosed
US-5703257-A Synthesis of cyclopentadienyl metal coordination complexes from metal hydrocarbyloxides THE DOW CHEMICAL COMPANY (US) 1997-12-30 US disclosed
EP-0741739-A1 SYNTHESIS OF CYCLOPENTADIENYL METAL COORDINATION COMPLEXES FROM METAL HYDROCARBYLOXIDES THE DOW CHEMICAL COMPANY (US) 1996-11-13 EP disclosed
WO-1996034001-A1 SYNTHESIS OF GROUP 4 METAL DIENE COMPLEXES THE DOW CHEMICAL COMPANY (US) 1996-10-31 WO disclosed
US-5504223-A Synthesis of cyclopentadienyl metal coordination complexes from metal hydrocarbyloxides THE DOW CHEMICAL COMPANY (US) 1996-04-02 US disclosed
US-5491246-A Synthesis of group 4 metal diene complexes THE DOW CHEMICAL COMPANY (US) 1996-02-13 US disclosed
WO-1995019984-A2 SYNTHESIS OF CYCLOPENTADIENYL METAL COORDINATION COMPLEXES FROM METAL HYDROCARBYLOXIDES THE DOW CHEMICAL COMPANY (US) 1995-07-27 WO disclosed