SCHEMBL17706993

SCHEMBL17706993

CCC=COCCN(CC)CCOC=CCC

nearest known ligand 0.38

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.38
POLB P06746 1/20 0.38
KMT2A Q03164 1/20 0.38

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
SCHEMBL17706878 0.84 MEN1 (0.36) MEN1POLBKMT2A
SCHEMBL438117 0.83 KDM4E (0.39) MEN1POLBKMT2A
SCHEMBL17707108 0.81 ESR1 (0.35) MEN1POLBKMT2A
SCHEMBL17707086 0.79
SCHEMBL17706978 0.77
Water SCHEMBL5684260 0.75 TRPA1 (0.30)
SCHEMBL17707134 0.74
SCHEMBL437212 0.72 BCHE (0.31) KMT2A
SCHEMBL845432 0.72 LPAR2 (0.33)
SCHEMBL18860351 0.72

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-3015471-B1 NOVEL BISALKOXYSILANE COMPOUND AND ITS PRODUCTION METHOD SHINETSU CHEMICAL CO (JP) 2018-02-28 EP disclosed
EP-3015471-A1 NOVEL BISALKOXYSILANE COMPOUND AND ITS PRODUCTION METHOD Shin-Etsu Chemical Co., Ltd. (JP) 2016-05-04 EP disclosed