SCHEMBL17935670

SCHEMBL17935670

N#CCC[Si](CCC#N)(CCC#N)CCC#N

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.50
TDP1 Q9NUW8 1/20 0.50
TSHR P16473 3/20 0.39
LOX P28300 1/20 0.39
LOXL3 P58215 1/20 0.39
LOXL2 Q9Y4K0 1/20 0.39
CYP3A4 P08684 1/20 0.39
PKM P14618 1/20 0.32
NLRP3 Q96P20 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
SCHEMBL29224804 0.85 TSHR (0.46) ALDH1A1TDP1TSHRLOXLOXL3
SCHEMBL18265525 0.83 ALDH1A1 (0.41) ALDH1A1TDP1TSHRLOXLOXL3
SCHEMBL10575370 0.81 TSHR (0.41) ALDH1A1TDP1TSHRLOXLOXL3
SCHEMBL29224794 0.74 TSHR (0.42) ALDH1A1TDP1TSHR
SCHEMBL2101357 0.72
SCHEMBL20637011 0.72 ALDH1A1 (0.44) ALDH1A1TDP1TSHRLOXLOXL3
SCHEMBL5681525 0.72
SCHEMBL20637001 0.72 ALDH1A1 (0.44) ALDH1A1TDP1TSHRLOXLOXL3
SCHEMBL8995402 0.72 ALDH1A1 (0.44) ALDH1A1TDP1TSHRLOXLOXL3
SCHEMBL16272581 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10777850-B2 Nonaqueous electrolytic solution and nonaqueous electrolyte secondary battery using the same MITSUBISHI CHEMICAL CORPORATION (JP) 2020-09-15 US disclosed
US-20190051941-A1 NONAQUEOUS ELECTROLYTIC SOLUTION AND NONAQUEOUS ELECTROLYTE SECONDARY BATTERY USING THE SAME MITSUBISHI CHEMICAL CORPORATION (JP) 2019-02-14 US disclosed
US-10177414-B2 Nonaqueous electrolytic solution and nonaqueous electrolyte secondary battery using the same MITSUBISHI CHEMICAL CORPORATION (JP) 2019-01-08 US disclosed
US-20160322669-A1 NONAQUEOUS ELECTROLYTIC SOLUTION AND NONAQUEOUS ELECTROLYTE SECONDARY BATTERY USING THE SAME MITSUBISHI CHEMICAL CORPORATION (JP) 2016-11-03 US disclosed
US-9461334-B2 Nonaqueous electrolytic solution and nonaqueous electrolyte battery using the same MITSUBISHI CHEMICAL CORPORATION (JP) 2016-10-04 US disclosed
US-20160211553-A1 NONAQUEOUS ELECTROLYTIC SOLUTION AND NONAQUEOUS ELECTROLYTE BATTERY USING SAME MITSUBISHI CHEMICAL CORPORATION (JP) 2016-07-21 US disclosed