SCHEMBL28089374

SCHEMBL28089374

CC(=O)[Si](CN)(C(C)=O)C(C)=O

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.35
ALOX15 P16050 2/20 0.35
BLM P54132 2/20 0.35
PMP22 Q01453 2/20 0.35
PAOX Q6QHF9 1/20 0.32
ALDH1A1 P00352 3/20 0.32
TDP1 Q9NUW8 2/20 0.32
GLRA1 P23415 1/20 0.32
SLC6A9 P48067 1/20 0.32
OR51E2 Q9H255 1/20 0.32
TRPA1 O75762 1/20 0.30
KDM4E B2RXH2 1/20 0.30
GMNN O75496 1/20 0.30
USP2 O75604 1/20 0.30
TP53 P04637 1/20 0.30
CYP1A2 P05177 1/20 0.30
GLA P06280 1/20 0.30
POLB P06746 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2C9 P11712 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
SCHEMBL149763 0.69 ALDH1A1 (0.41) LMNAALDH1A1TDP1TRPA1THPO
SCHEMBL6702590 0.69 TDP1 (0.35) ALDH1A1TDP1
SCHEMBL14760296 0.67 ALDH1A1 (0.37) LMNAALOX15BLMPMP22ALDH1A1
SCHEMBL14760288 0.67 ALDH1A1 (0.32) LMNAALDH1A1TDP1TRPA1HSD17B10
SCHEMBL14760124 0.67 ALDH1A1 (0.39) LMNAALDH1A1TDP1TRPA1
SCHEMBL14760277 0.67 TRPA1 (0.44) LMNAALDH1A1TDP1TRPA1
SCHEMBL28576565 0.65 ALDH1A1 (0.37) LMNAPAOXALDH1A1TDP1CYP3A4
Acetic Acid SCHEMBL31377001 0.62 FFAR3 (0.64) LMNAALOX15BLMPMP22PAOX
Acetic Acid SCHEMBL6662900 0.62 FFAR3 (0.64) LMNAALOX15BLMPMP22PAOX
Acetic Acid SCHEMBL449532 0.62 FFAR3 (0.64) LMNAALOX15BLMPMP22PAOX

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-105848773-A Three-dimensional microchemical chip 株式会社朝日精细橡胶研究所 2016-08-10 CN disclosed