SCHEMBL28790096

SCHEMBL28790096

CCCN(C(C)=O)[Si](CC)(CC)N(CCC)C(C)=O

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.34
CA2 P00918 1/20 0.34
CA9 Q16790 1/20 0.34
TSHR P16473 1/20 0.32
MAPK1 P28482 1/20 0.32
ALDH1A1 P00352 1/20 0.30
HPGD P15428 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
SCHEMBL28790102 0.80 CHRM1 (0.32) ALDH1A1
SCHEMBL28790113 0.78 CA12 (0.36) CA12CA2CA9TSHRMAPK1
SCHEMBL11765231 0.74 CA12 (0.30) CA12CA2CA9
SCHEMBL22769503 0.71 CA12 (0.31) CA12CA2CA9
SCHEMBL11066762 0.68 CA12 (0.43) CA12CA9ALDH1A1
SCHEMBL11329616 0.67 ALDH1A1 (0.33) ALDH1A1
SCHEMBL29009674 0.67 CHRM2 (0.30)
SCHEMBL11408090 0.66 CA12 (0.42) CA12CA2CA9TSHRMAPK1
SCHEMBL483128 0.66 CA12 (0.55) CA12CA2CA9TSHRMAPK1
SCHEMBL1277684 0.65 CA12 (0.40) CA12CA9ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116507668-B Additive stabilization 美国陶氏有机硅公司 2024-05-31 CN disclosed
CN-117377715-A Silicone composition and preparation thereof 美国陶氏有机硅公司 2024-01-09 CN disclosed
CN-114901725-B Polydiorganosiloxane preparation 美国陶氏有机硅公司 2023-09-08 CN disclosed
CN-116507668-A Additive stabilization 美国陶氏有机硅公司 2023-07-28 CN disclosed
CN-116209721-A Polydiorganosiloxane preparation 美国陶氏有机硅公司 2023-06-02 CN disclosed
CN-116171298-A Polydiorganosiloxane preparation 美国陶氏有机硅公司 2023-05-26 CN disclosed
CN-114901725-A Preparation of polydiorganosiloxane 美国陶氏有机硅公司 2022-08-12 CN disclosed
CN-114787263-A Sealant composition 美国陶氏有机硅公司 2022-07-22 CN disclosed