SCHEMBL5531307

SCHEMBL5531307

C[SiH](C)Oc1ccc(C=Cc2ccccc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 1/20 0.61
RELA Q04206 3/20 0.55
CHRNA7 P36544 3/20 0.47
CYP3A4 P08684 2/20 0.47
MTOR P42345 2/20 0.47
CHRNB4 P30926 2/20 0.47
CHRNA3 P32297 2/20 0.47
CHRNA10 Q9GZZ6 2/20 0.47
CHRNA9 Q9UGM1 2/20 0.47
CYP1A2 P05177 1/20 0.47
THPO P40225 1/20 0.47
HIF1A Q16665 1/20 0.47
RAB9A P51151 1/20 0.47
NPC1 O15118 1/20 0.46
KDM4E B2RXH2 1/20 0.46
GMNN O75496 1/20 0.46
ALDH1A1 P00352 1/20 0.46
LMNA P02545 1/20 0.46
BLM P54132 1/20 0.46
PMP22 Q01453 1/20 0.46

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
SCHEMBL1867149 0.81 TRPA1 (0.57) TRPA1RELACHRNA7CYP3A4MTOR
SCHEMBL2354326 0.79 CA4 (0.48) ALDH1A1LMNAMAOA
SCHEMBL2166503 0.79 RELA (0.59) TRPA1RELACHRNA7CYP3A4MTOR
SCHEMBL2167863 0.77 RELA (0.58) TRPA1RELACHRNA7CYP3A4MTOR
SCHEMBL8845585 0.76 TRPA1 (1.00) TRPA1RELACYP3A4CYP1A2RAB9A
SCHEMBL699620 0.76 TRPA1 (1.00) TRPA1RELACYP3A4CYP1A2RAB9A
SCHEMBL699621 0.76 TRPA1 (1.00) TRPA1RELACYP3A4CYP1A2RAB9A
SCHEMBL1654499 0.75 TRPA1 (0.67) TRPA1RELACHRNA7CYP3A4MTOR
SCHEMBL10031842 0.75 TRPA1 (0.67) TRPA1RELACHRNA7CYP3A4MTOR
SCHEMBL10870845 0.74 ALDH1A1 (0.50) TRPA1RELACHRNA7CYP3A4CHRNB4

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
US-20070218390-A1 TONER FOR DEVELOPING ELECTROSTATIC IMAGES, PRODUCTION METHOD THEREOF; DEVELOPER, IMAGE FORMING METHOD, IMAGE FORMING APPARATUS, AND PROCESS CARTRIDGE RICOH COMPANY LTD. (JP) 2007-09-20 US disclosed