SCHEMBL3133242

SCHEMBL3133242

c1ccc(CN[SiH2]NCc2ccccc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.52
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
THRB P10828 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
MAPT P10636 4/20 0.50
CYP3A4 P08684 2/20 0.50
KDM4E B2RXH2 1/20 0.50
CA12 O43570 3/20 0.46
CA2 P00918 3/20 0.46
ALOX12 P18054 2/20 0.46
CA7 P43166 2/20 0.46
CA14 Q9ULX7 2/20 0.46
ADH1B P00325 1/20 0.46
ADH1C P00326 1/20 0.46
ADH1A P07327 1/20 0.46
ADH7 P40394 1/20 0.46
ALDH1A1 P00352 1/20 0.46
HPGD P15428 1/20 0.46
MAOA P21397 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
SCHEMBL29128805 0.85 IDO1 (0.50) IDO1MEN1KMT2ATHRBTDP1
SCHEMBL31302856 0.81 IDO1 (0.50) IDO1MEN1KMT2ATHRBTDP1
SCHEMBL18692045 0.79 IDO1 (0.48) IDO1MEN1KMT2ATHRBTDP1
SCHEMBL16582961 0.79 IDO1 (0.48) IDO1MEN1KMT2ATHRBTDP1
SCHEMBL14813087 0.79 IDO1 (0.48) IDO1MEN1KMT2ATHRBTDP1
SCHEMBL16583005 0.75 IDO1 (0.44) IDO1MEN1KMT2ATHRBTDP1
SCHEMBL10713569 0.75 CYP3A4 (0.48) IDO1MEN1KMT2ATHRBTDP1
SCHEMBL19973229 0.74 IDO1 (0.43) IDO1MEN1KMT2ATHRBTDP1
SCHEMBL897646 0.74 ADH1B (0.43) IDO1MEN1KMT2ATHRBTDP1
Benzene SCHEMBL11697595 0.73 MEN1 (0.78) IDO1MEN1KMT2ATHRBTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109266181-A A kind of ceramic modified epoxy coating of fire resistant water-based inorganic nano and preparation method thereof 湖南凯斯利新材料有限公司 2019-01-25 CN claimed
US-20100009546-A1 Aminosilanes for Shallow Trench Isolation Films AIR PRODUCTS AND CHEMICALS, INC. (US) 2010-01-14 US claimed
EP-2144279-A2 Aminosilanes for shallow trench isolation films Air Products and Chemicals, Inc. (US) 2010-01-13 EP claimed
CN-109266181-A A kind of ceramic modified epoxy coating of fire resistant water-based inorganic nano and preparation method thereof 湖南凯斯利新材料有限公司 2019-01-25 CN disclosed
EP-2144279-A2 Aminosilanes for shallow trench isolation films Air Products and Chemicals, Inc. (US) 2010-01-13 EP disclosed