SCHEMBL6676176

SCHEMBL6676176

C=C[SiH2]C1(c2ccccc2)CCCCO1

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GRIN2D O15399 1/20 0.34
GRIN3B O60391 1/20 0.34
CYP2B6 P20813 1/20 0.34
SLC6A2 P23975 1/20 0.34
SLC6A4 P31645 1/20 0.34
PRCP P42785 1/20 0.34
SLC6A3 Q01959 1/20 0.34
GRIN1 Q05586 1/20 0.34
KCNH2 Q12809 1/20 0.34
GRIN2A Q12879 1/20 0.34
GRIN2B Q13224 1/20 0.34
GRIN2C Q14957 1/20 0.34
GRIN3A Q8TCU5 1/20 0.34
SIGMAR1 Q99720 1/20 0.34
OPRM1 P35372 1/20 0.33
OPRD1 P41143 1/20 0.33
DPP4 P27487 1/20 0.33
AKR1C1 Q04828 1/20 0.33

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
SCHEMBL27925168 0.84 ESR2 (0.41)
SCHEMBL5571648 0.84 HSD11B1 (0.32)
SCHEMBL28066193 0.81
SCHEMBL116500 0.78 DPP4 (0.35) SLC6A2SLC6A4SLC6A3OPRM1DPP4
SCHEMBL10807455 0.78 DPP4 (0.35) GRIN2DGRIN3BCYP2B6SLC6A2SLC6A4
SCHEMBL8591995 0.74 DPP4 (0.36) SLC6A2SLC6A4SLC6A3DPP4
SCHEMBL2356054 0.74 SLC6A4 (0.33) SLC6A2SLC6A4SLC6A3OPRM1DPP4
SCHEMBL7202132 0.72
SCHEMBL29035084 0.71 DRD3 (0.35) SLC6A2SLC6A4SLC6A3OPRM1OPRD1
SCHEMBL19580118 0.71 DPP4 (0.33) SLC6A2SLC6A4SLC6A3KCNH2DPP4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2004038084-A2 FABRIC CARE COMPOSITIONS THE CLOROX COMPANY (US) 2004-05-06 WO claimed
CN-108139673-A Material, preparation method and its application method comprising metal oxide AZ电子材料卢森堡有限公司 2018-06-08 CN disclosed
CN-101993639-B Release coating material SHANGHAI YONGGUAN ADHESIVE PRODUCTS CO LTD 2012-08-29 CN disclosed
CN-101993639-A Release coating material SHANGHAI YONGGUAN ADHESIVE PRODUCTS CO LTD 2011-03-30 CN disclosed