SCHEMBL27999991

SCHEMBL27999991

COc1ccc(C[SiH](OC)OC)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 5/20 0.52
CA12 O43570 1/20 0.50
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
CA7 P43166 1/20 0.50
CA9 Q16790 1/20 0.50
CA14 Q9ULX7 1/20 0.50
AGXT P21549 2/20 0.48
LTA4H P09960 1/20 0.48
TAAR1 Q96RJ0 1/20 0.48
SIGMAR1 Q99720 1/20 0.47
ALDH1A1 P00352 2/20 0.47
ALOX15 P16050 2/20 0.47
TP53 P04637 1/20 0.47
CYP3A4 P08684 1/20 0.47
TSHR P16473 1/20 0.47
ALOX12 P18054 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
SLC6A4 P31645 1/20 0.45
HRH3 Q9Y5N1 1/20 0.44

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
SCHEMBL23803510 0.79 APP (0.34) IDO1SIGMAR1SMN1; SMN2
SCHEMBL9412745 0.79 ALDH1A1 (0.41) IDO1CA2TAAR1ALDH1A1TP53
SCHEMBL384789 0.79 AGXT (0.43) IDO1CA1CA2CA9AGXT
SCHEMBL27534857 0.79 IDO1 (0.54) IDO1CA12CA1CA2CA7
SCHEMBL17937819 0.77 IDO1 (0.41) IDO1AGXTTAAR1ALDH1A1SLC6A4
SCHEMBL963476 0.77 CA1 (0.34) CA1CA2
SCHEMBL5305924 0.77 IDO1 (0.52) IDO1CA12CA1CA2CA7
SCHEMBL483523 0.77 TDP1 (0.44) TAAR1ALDH1A1CYP3A4TSHRMAPT
SCHEMBL17937673 0.77 IDO1 (0.41) IDO1TAAR1ALDH1A1KDM4EMAPT
SCHEMBL6890461 0.77 ESR1 (0.44) IDO1CA2TAAR1SIGMAR1ALDH1A1

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
CN-104508056-B adjustable material 特斯拉纳米涂料有限公司 2017-03-29 CN disclosed
CN-104508056-A Tunable materials TESLA NANOCOATINGS INC 2015-04-08 CN disclosed