SCHEMBL7752850

SCHEMBL7752850

C=CCc1cccc([Si](CC(C)C)(CC(C)C)CC(C)C)c1S(=O)(=O)O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 1/20 0.36
GABRB2 P47870 1/20 0.36
ADRA2C P18825 6/20 0.33
ADRA2A P08913 5/20 0.33
ADRA2B P18089 5/20 0.33
POLB P06746 1/20 0.32
LMNA P02545 3/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
MAPT P10636 1/20 0.32
PKM P14618 1/20 0.32
HTT P42858 1/20 0.32
HIF1A Q16665 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
ADRB2 P07550 3/20 0.31
ADRB1 P08588 3/20 0.31
HTR1A P08908 3/20 0.31
KCNH2 Q12809 2/20 0.31
ADRB3 P13945 1/20 0.31
SLC6A2 P23975 1/20 0.31

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
SCHEMBL7756788 0.85 GABRA1 (0.33) GABRA1GABRB2ADRA2CADRA2AADRA2B
SCHEMBL7755453 0.81 SLC9A1 (0.32)
SCHEMBL7755436 0.81
SCHEMBL7755481 0.80 GABRA1 (0.34) GABRA1GABRB2ADRA2CADRA2AADRA2B
SCHEMBL7752860 0.78 GABRA1 (0.37) GABRA1GABRB2POLBLMNAMEN1
SCHEMBL7755424 0.77 GABRA1 (0.36) GABRA1GABRB2POLBLMNAMEN1
SCHEMBL7756902 0.75 GABRA1 (0.36) GABRA1GABRB2ADRA2CADRA2AADRA2B
SCHEMBL4464469 0.74 GABRA1 (0.43) GABRA1GABRB2POLBLMNAMEN1
SCHEMBL729518 0.74 GABRA1 (0.43) GABRA1GABRB2POLBMEN1KMT2A
SCHEMBL5184511 0.74 GABRA1 (0.46) GABRA1GABRB2POLBLMNAMEN1

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
WO-2001060932-A1 ANTIFOULING PAINT COMPOSITION J.C. HEMPEL'S SKIBSFARVE-FABRIK A/S (DK) 2001-08-23 WO disclosed