SCHEMBL28128704

SCHEMBL28128704

O[Si](O)(O)OOCc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.48
IDO1 P14902 1/20 0.44
AGXT P21549 1/20 0.43
ALDH1A1 P00352 4/20 0.42
SLC6A2 P23975 2/20 0.42
SLC6A3 Q01959 2/20 0.42
LMNA P02545 2/20 0.42
CYP1A2 P05177 1/20 0.42
PTGS1 P23219 1/20 0.42
CYP2C19 P33261 1/20 0.42
PTGS2 P35354 1/20 0.42
HIF1A Q16665 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42
CA1 P00915 3/20 0.41
CA2 P00918 3/20 0.41
CA9 Q16790 3/20 0.41
MAPK1 P28482 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
CA12 O43570 1/20 0.41
KMT2A Q03164 1/20 0.41

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
Phosphine SCHEMBL28182122 0.98 TSHR (0.46) TSHRIDO1AGXTALDH1A1SLC6A2
SCHEMBL177923 0.77 TSHR (0.67) TSHRIDO1AGXTALDH1A1SLC6A2
SCHEMBL997761 0.76 TSHR (0.52) TSHRIDO1AGXTALDH1A1SLC6A2
SCHEMBL11117973 0.76 TSHR (0.46) TSHRIDO1AGXTALDH1A1SLC6A2
Water SCHEMBL28419682 0.75 TSHR (0.63) TSHRIDO1AGXTALDH1A1SLC6A2
SCHEMBL4363419 0.75 TSHR (0.63) TSHRIDO1AGXTALDH1A1SLC6A2
SCHEMBL19253313 0.74 TSHR (0.44) TSHRIDO1AGXTALDH1A1SLC6A2
Bicarbonate SCHEMBL9066694 0.73 ALDH1A1 (0.58) TSHRIDO1AGXTALDH1A1SLC6A2
SCHEMBL10590101 0.73 TSHR (0.55) TSHRIDO1AGXTALDH1A1SLC6A2
SCHEMBL876547 0.72 TSHR (0.60) TSHRIDO1AGXTALDH1A1SLC6A2

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-106478727-B Fire retardant Phenylmethoxy silicic acid disulfide group phospha trioxa-l-phosphabicyclo octyl methyl compound and preparation method thereof 苏州科技大学 2018-12-11 CN claimed
CN-106478727-A Fire retardant Phenylmethoxy silicic acid disulfide group phospha trioxa-l-phosphabicyclo octyl group methyl compound and preparation method thereof 苏州科技大学 2017-03-08 CN claimed
CN-115505238-A Carbon fiber RS4 air box guide pipe and preparation method thereof 嘉兴翔翌复合材料有限公司 2022-12-23 CN disclosed
CN-106478727-B Fire retardant Phenylmethoxy silicic acid disulfide group phospha trioxa-l-phosphabicyclo octyl methyl compound and preparation method thereof 苏州科技大学 2018-12-11 CN disclosed
CN-106478727-B Fire retardant Phenylmethoxy silicic acid disulfide group phospha trioxa-l-phosphabicyclo octyl methyl compound and preparation method thereof 苏州科技大学 2018-12-11 CN disclosed
CN-106478727-A Fire retardant Phenylmethoxy silicic acid disulfide group phospha trioxa-l-phosphabicyclo octyl group methyl compound and preparation method thereof 苏州科技大学 2017-03-08 CN disclosed
CN-106478727-A Fire retardant Phenylmethoxy silicic acid disulfide group phospha trioxa-l-phosphabicyclo octyl group methyl compound and preparation method thereof 苏州科技大学 2017-03-08 CN disclosed