SCHEMBL30923503

SCHEMBL30923503

C[Si](C)(C)O[SiH](C=Cc1ccccc1)O[Si](C)(C)C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 3/20 0.44
MAOB P27338 1/20 0.39
ALDH1A1 P00352 4/20 0.39
LMNA P02545 1/20 0.39
ALOX5 P09917 1/20 0.39
MAPK1 P28482 1/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
CHAT P28329 2/20 0.36
RELA Q04206 2/20 0.36
KDM4E B2RXH2 2/20 0.36
HPGD P15428 2/20 0.36
NFE2L2 Q16236 1/20 0.36
CYP11B1 P15538 1/20 0.35
CYP11B2 P19099 1/20 0.35
GLA P06280 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
NPC1 O15118 1/20 0.35
GRM5 P41594 1/20 0.35
RAB9A P51151 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
SCHEMBL6657182 0.79 TRPA1 (0.31) TRPA1MAOBALDH1A1LMNAALOX5
SCHEMBL1083090 0.77 TRPA1 (0.48) TRPA1MAOBALDH1A1MEN1KMT2A
SCHEMBL73089 0.72 RELA (0.48) TRPA1MAOBALDH1A1LMNAMEN1
SCHEMBL2502119 0.72 TRPA1 (0.39) TRPA1MAOBALDH1A1MEN1KMT2A
SCHEMBL9419106 0.69 MAOB (0.38) TRPA1MAOBALDH1A1MEN1KMT2A
SCHEMBL15661092 0.69 GLA (0.50) MAOBALDH1A1LMNAMEN1KMT2A
SCHEMBL3626138 0.69 RELA (0.42) TRPA1MAOBALDH1A1LMNAMEN1
SCHEMBL3627696 0.69 MAOB (0.50) TRPA1MAOBALDH1A1LMNAALOX5
SCHEMBL28709885 0.69 MAOB (0.50) TRPA1MAOBALDH1A1LMNAALOX5
SCHEMBL766940 0.69 MAOB (0.50) TRPA1MAOBALDH1A1LMNAALOX5

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-113543753-B Method for absorbing or discharging moisture in ophthalmic medical device and ophthalmic medical device 国立大学法人东北大学 2024-04-19 CN disclosed