SCHEMBL28147453

SCHEMBL28147453

CCO[Si](C)(C)OC(C)(CN)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.36
KIF11 P52732 4/20 0.36
MAPK1 P28482 1/20 0.33
ALDH1A1 P00352 1/20 0.32
ALOX15 P16050 1/20 0.32
SLC6A2 P23975 1/20 0.32
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2D6 P10635 1/20 0.31
PRMT1 Q99873 1/20 0.31
KCNN4 O15554 1/20 0.31
TSHR P16473 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
SCHEMBL28327111 0.81 TAAR1 (0.41) TAAR1SMN1; SMN2KIF11MAPK1ALDH1A1
SCHEMBL28518052 0.80 MAPK1 (0.47) TAAR1SMN1; SMN2KIF11MAPK1ALDH1A1
SCHEMBL28657230 0.80 MAPK1 (0.38) TAAR1MAPK1ALDH1A1ALOX15SLC6A2
SCHEMBL29105011 0.70 TAAR1 (0.37) TAAR1SMN1; SMN2KIF11MAPK1ALDH1A1
SCHEMBL9716571 0.68 MAPK1 (0.40) TAAR1SMN1; SMN2KIF11MAPK1ALDH1A1
Benzylamine SCHEMBL27946848 0.68 LOXL2 (0.56) TAAR1SMN1; SMN2SLC6A2CYP1A2CYP2D6
SCHEMBL2452793 0.68 MAPK1 (0.40) TAAR1MAPK1ALDH1A1ALOX15SLC6A2
SCHEMBL9716560 0.67 MAPK1 (0.43) TAAR1MAPK1ALDH1A1ALOX15CYP3A4
SCHEMBL6888166 0.67 MAPK1 (0.32) TAAR1MAPK1ALDH1A1ALOX15KCNN4
SCHEMBL27923944 0.67 MAPK1 (0.32) TAAR1MAPK1ALDH1A1ALOX15KCNN4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110478842-A Lithium electricity compound fire-extinguishing agent ZHEJIANG NARADA POWER SOURCE 2019-11-22 CN claimed
CN-106785126-B A kind of flame-retardant additive and preparation method thereof, lithium battery 青岛大学 2019-10-11 CN claimed
CN-106785126-A A kind of flame-retardant additive and preparation method thereof, lithium battery 青岛大学 2017-05-31 CN claimed
CN-106785126-B A kind of flame-retardant additive and preparation method thereof, lithium battery 青岛大学 2019-10-11 CN disclosed
CN-209447856-U Battery flame retarding construction and battery 潍柴动力股份有限公司 2019-09-27 CN disclosed
CN-109818055-A A kind of electrolyte of the anti-thermal runaway of width warm area and its serondary lithium battery of composition 中国科学院青岛生物能源与过程研究所 2019-05-28 CN disclosed
CN-106785126-A A kind of flame-retardant additive and preparation method thereof, lithium battery 青岛大学 2017-05-31 CN disclosed