SCHEMBL30992120

SCHEMBL30992120

CC1(OO)CCCCCC1=O

nearest known ligand 0.33

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.33
CYP19A1 P11511 1/20 0.31
ALDH1A1 P00352 3/20 0.31
SLC6A4 P31645 2/20 0.30
GRIN1 Q05586 2/20 0.30
GRIN2A Q12879 2/20 0.30
OPRK1 P41145 1/20 0.30
GRIN2D O15399 1/20 0.30
GRIN3B O60391 1/20 0.30
LMNA P02545 1/20 0.30
OPRM1 P35372 1/20 0.30
GRIN2B Q13224 1/20 0.30
CACNA1C Q13936 1/20 0.30
GRIN2C Q14957 1/20 0.30
GRIN3A Q8TCU5 1/20 0.30
HTT P42858 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
SCHEMBL30992129 0.98 POLB (0.34) POLBCYP19A1ALDH1A1SLC6A4GRIN1
SCHEMBL30992122 0.91
SCHEMBL23168690 0.78 GRIN1 (0.33) POLBSLC6A4GRIN1GRIN2AOPRK1
SCHEMBL4564982 0.76 CYP19A1 (0.39) POLBCYP19A1HTT
SCHEMBL30992128 0.73
SCHEMBL9878833 0.72 CYP19A1 (0.32) POLBCYP19A1GRIN1GRIN2AOPRK1
SCHEMBL10888167 0.71
SCHEMBL19411896 0.71 POLB (0.39) POLBCYP19A1ALDH1A1SLC6A4GRIN1
SCHEMBL19411897 0.71 POLB (0.39) POLBCYP19A1ALDH1A1SLC6A4GRIN1
SCHEMBL30992158 0.71

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118373842-A Alpha/beta-functionalized alkylsilane-based peroxide, method for free radical conversion under Fe catalysis and application thereof 广东工业大学 2024-07-23 CN disclosed