SCHEMBL8467142

SCHEMBL8467142

C=C(C(=C)[Si](C)(C)C)[Si](C)(C)C.C[Ti](C)(NC(=O)c1ccccc1)C1C2C=CC=CC2C2CCCCC21.[SiH4]

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ADCY1 Q08828 1/20 0.32
RAB9A P51151 4/20 0.32
ALDH1A1 P00352 2/20 0.32
NPC1 O15118 3/20 0.32
TP53 P04637 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
HPGD P15428 1/20 0.30
PKM P14618 1/20 0.30
HTT P42858 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL8463421 0.91 RAB9A (0.33) RAB9AALDH1A1NPC1TP53SMN1; SMN2
SCHEMBL8677279 0.91 RAB9A (0.33) RAB9AALDH1A1NPC1TP53SMN1; SMN2
Butadiene SCHEMBL8465296 0.89 RAB9A (0.33) RAB9AALDH1A1NPC1TP53SMN1; SMN2
SCHEMBL8677042 0.81 HSD11B1 (0.31)
SCHEMBL8678494 0.80 ALDH1A1 (0.37) RAB9AALDH1A1SMN1; SMN2HPGDHTT
SCHEMBL8581525 0.79 ALDH1A1 (0.33) ADCY1RAB9AALDH1A1TP53SMN1; SMN2
SCHEMBL8465566 0.77
SCHEMBL8678366 0.77
SCHEMBL8523353 0.76
SCHEMBL8463610 0.76

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0767795-B1 GROUP 4 METAL DIENE COMPLEXES AND ADDITION POLYMERIZATION CATALYSTS THEREFROM DOW CHEMICAL CO (US) 1999-12-22 EP disclosed
US-5770538-A Group 4 metal diene complexes and addition polymerization catalysts therefrom THE DOW CHEMICAL COMPANY (US) 1998-06-23 US disclosed
EP-0767795-A1 GROUP 4 METAL DIENE COMPLEXES AND ADDITION POLYMERIZATION CATALYSTS THEREFROM THE DOW CHEMICAL COMPANY (US) 1997-04-16 EP disclosed
US-5486632-A Group 4 metal diene complexes and addition polymerization catalysts therefrom THE DOW CHEMICAL COMPANY (US) 1996-01-23 US disclosed
WO-1996000734-A1 GROUP 4 METAL DIENE COMPLEXES AND ADDITION POLYMERIZATION CATALYSTS THEREFROM THE DOW CHEMICAL COMPANY (US) 1996-01-11 WO disclosed