SCHEMBL30007259

SCHEMBL30007259

C[Si](C)(C)O[Si](CC(CCl)c1ccccc1)(O[Si](C)(C)C)O[Si](C)(C)C

nearest known ligand 0.32

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 2/20 0.32
CYP1A2 P05177 1/20 0.32
PKM P14618 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
TAAR1 Q96RJ0 2/20 0.31
SLC6A2 P23975 2/20 0.31
SLC6A4 P31645 2/20 0.31
SLC6A3 Q01959 2/20 0.31
TSHR P16473 1/20 0.30
EPHX1 P07099 1/20 0.30
IDO1 P14902 1/20 0.30
TDO2 P48775 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
SCHEMBL485620 0.82 SMN1; SMN2 (0.33) CYP2D6CYP1A2PKMSMN1; SMN2NPSR1
SCHEMBL2881080 0.79 LMNA (0.33) CYP2D6CYP1A2PKMSMN1; SMN2NPSR1
SCHEMBL2100574 0.78 TSHR (0.34) CYP2D6CYP1A2PKMSMN1; SMN2NPSR1
SCHEMBL2220085 0.78 LMNA (0.38) CYP2D6TAAR1SLC6A2SLC6A4SLC6A3
SCHEMBL2543705 0.77 EPHX1 (0.34) CYP2D6CYP1A2PKMSMN1; SMN2NPSR1
SCHEMBL2101611 0.74 TSHR (0.37) CYP2D6CYP1A2PKMSMN1; SMN2NPSR1
SCHEMBL5598365 0.72 TSHR (0.48) CYP2D6CYP1A2PKMSMN1; SMN2NPSR1
SCHEMBL2237751 0.69 LMNA (0.48) CYP2D6TAAR1TSHR
SCHEMBL6230663 0.68 HRH1 (0.39) TAAR1SLC6A2SLC6A4SLC6A3
SCHEMBL1197511 0.68 EPHX1 (0.36) CYP2D6CYP1A2PKMSMN1; SMN2NPSR1

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-115461143-A Compositions, methods, and systems for sample processing 10X基因组学有限公司 2022-12-09 CN disclosed