SCHEMBL8675178

SCHEMBL8675178

C=CC(C)=CC.C[Ti](C)(NCc1ccccc1)C1C=Cc2ccccc21.[SiH4]

nearest known ligand 0.37

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 6/20 0.37

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
SCHEMBL8061004 0.81
SCHEMBL8056636 0.79 MEN1 (0.30)
SCHEMBL8463592 0.68
Butadiene SCHEMBL8466562 0.68 MEN1 (0.33)
Butadiene SCHEMBL8463315 0.67 SIGMAR1 (0.31) SIGMAR1
Butadiene SCHEMBL8523143 0.67
SCHEMBL8523278 0.67
SCHEMBL8633044 0.66 SIGMAR1 (0.30) SIGMAR1
SCHEMBL8057508 0.66 MEN1 (0.30)
SCHEMBL8057584 0.66 SIGMAR1 (0.34) SIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0822937-A1 SYNTHESIS OF GROUP 4 METAL DIENE COMPLEXES THE DOW CHEMICAL COMPANY (US) 1998-02-11 EP disclosed
WO-1996034001-A1 SYNTHESIS OF GROUP 4 METAL DIENE COMPLEXES THE DOW CHEMICAL COMPANY (US) 1996-10-31 WO disclosed
US-5491246-A Synthesis of group 4 metal diene complexes THE DOW CHEMICAL COMPANY (US) 1996-02-13 US disclosed