SCHEMBL4896613

SCHEMBL4896613

CCCCCCCCCC(C)n1ccnc1C[Si](OCC)(OCC)OCC

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ADA P00813 2/20 0.33
LMNA P02545 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
ALDH1A1 P00352 1/20 0.33
CYP2C19 P33261 1/20 0.33
TLR7 Q9NYK1 1/20 0.31
TLR8 Q9NR97 2/20 0.31

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
SCHEMBL4897355 1.00 ADA (0.33) ADALMNASMN1; SMN2ALDH1A1CYP2C19
SCHEMBL4898362 0.88 ADA (0.34) ADALMNASMN1; SMN2ALDH1A1CYP2C19
SCHEMBL4895847 0.88 ADA (0.34) ADALMNASMN1; SMN2ALDH1A1CYP2C19
SCHEMBL4898302 0.87 ADA (0.32) ADALMNASMN1; SMN2ALDH1A1CYP2C19
SCHEMBL4896303 0.87 ADA (0.32) ADALMNASMN1; SMN2ALDH1A1CYP2C19
SCHEMBL4892834 0.86 ADA (0.32) ADALMNASMN1; SMN2ALDH1A1CYP2C19
SCHEMBL4898585 0.86 ADA (0.32) ADALMNASMN1; SMN2ALDH1A1CYP2C19
SCHEMBL11496905 0.80 TLR8 (0.40) ADALMNASMN1; SMN2ALDH1A1CYP2C19
SCHEMBL4899771 0.78 LMNA (0.33) ADALMNASMN1; SMN2ALDH1A1CYP2C19
SCHEMBL4897942 0.78 LMNA (0.33) ADALMNASMN1; SMN2ALDH1A1CYP2C19

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
US-20080274305-A1 Liquid Crystal Sealant and Liquid Crystal Display Cell Utilizing the Same NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2008-11-06 US disclosed
EP-1780587-A1 LIQUID CRYSTAL SEALANT AND LIQUID CRYSTAL DISPLAY CELL UTILIZING THE SAME Nippon Kayaku Kabushiki Kaisha (JP) 2007-05-02 EP disclosed