SCHEMBL7777478

SCHEMBL7777478

CC(C[SiH](CC(C)c1ccccc1)O[SiH3])c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 6/20 0.47
AOC3 Q16853 2/20 0.42
TRPA1 O75762 4/20 0.41
RIPK1 Q13546 1/20 0.41
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35
GFER P55789 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
TACR1 P25103 1/20 0.35

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
SCHEMBL11678634 0.91 TAAR1 (0.42) TAAR1AOC3TRPA1RIPK1KDM4E
SCHEMBL18389692 0.84 TAAR1 (0.47) TAAR1AOC3TRPA1RIPK1KDM4E
SCHEMBL4267109 0.82 TAAR1 (0.45) TAAR1AOC3TRPA1RIPK1KDM4E
SCHEMBL3157144 0.81 HTR2A (0.41) TAAR1
SCHEMBL6576657 0.77 TAAR1 (0.40) TAAR1AOC3TRPA1RIPK1
SCHEMBL11313458 0.74 TAAR1 (0.54) TAAR1AOC3TRPA1RIPK1KDM4E
SCHEMBL9230452 0.73 TAAR1 (0.48) TAAR1AOC3TRPA1RIPK1KDM4E
SCHEMBL10902064 0.73 TAAR1 (0.37) TAAR1AOC3TRPA1RIPK1ALDH1A1
SCHEMBL4262737 0.72 TAAR1 (0.52) TAAR1AOC3TRPA1RIPK1KDM4E
SCHEMBL6268405 0.72 TAAR1 (0.52) TAAR1AOC3TRPA1RIPK1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1126816-A1 METHOD OF USING AN ARALKYLSILOXANE GENERAL ELECTRIC COMPANY (US) 2001-08-29 EP disclosed
WO-2000027348-A1 METHOD OF USING AN ARALKYLSILOXANE GENERAL ELECTRIC COMPANY (US) 2000-05-18 WO disclosed