SCHEMBL6064320

SCHEMBL6064320

CC1=C(C)C(C)C([Ti](NC2CCCCCCCCCCC2)[SiH](c2ccccc2)c2ccccc2)=C1C.CCC(C)N[Ti](C1=C(C)C(C)=C(C)C1C)[SiH](c1ccccc1)c1ccccc1

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 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
SCHEMBL5824120 0.88 ADORA3 (0.31) NPC1
SCHEMBL6062575 0.88 ADORA3 (0.31) NPC1
SCHEMBL5663725 0.88 ADORA3 (0.31) NPC1
SCHEMBL821142 0.88
Hydrochloric Acid SCHEMBL5856929 0.87
Biphenyl SCHEMBL7653183 0.85 ADORA3 (0.33)
Biphenyl SCHEMBL7653510 0.85 ADORA3 (0.33)
Biphenyl SCHEMBL7652667 0.85 ADORA3 (0.33)
Biphenyl SCHEMBL7650492 0.85 ADORA3 (0.33)
Biphenyl SCHEMBL7651019 0.85 ADORA3 (0.33)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1732954-A2 POLYMERIZATION MONITORING AND METHOD OF SELECTING LEADING INDICATORS Univation Technologies LLC (US) 2006-12-20 EP disclosed
WO-2005040226-A2 POLYMERIZATION MONITORING AND METHOD OF SELECTING LEADING INDICATORS UNIVATION TECHNOLOGIES, LLC (US) 2005-05-06 WO disclosed