SCHEMBL29090347

SCHEMBL29090347

CCCCN(CCCC)C[SiH2]CN(CCCC)CCCC

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 3/20 0.37
CA1 P00915 3/20 0.37
CA9 Q16790 3/20 0.37
MAPT P10636 1/20 0.35
DNM1 Q05193 3/20 0.33
TSHR P16473 2/20 0.33
LMNA P02545 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
ALDH1A1 P00352 1/20 0.32
ALDH2 P05091 1/20 0.32
THRB P10828 1/20 0.32
KDM5A P29375 1/20 0.31
KCNH2 Q12809 2/20 0.31
MMP1 P03956 1/20 0.30
MMP2 P08253 1/20 0.30
MMP3 P08254 1/20 0.30
MMP8 P22894 1/20 0.30
CA2 P00918 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
SCHEMBL27566038 0.77 TSHR (0.46) CA12CA1CA9MAPTDNM1
SCHEMBL896 0.77 TSHR (0.46) CA12CA1CA9MAPTDNM1
SCHEMBL3904839 0.77 TSHR (0.46) CA12CA1CA9MAPTDNM1
Iodide SCHEMBL328995 0.74 CA12 (0.43) CA12CA1CA9MAPTDNM1
SCHEMBL6664330 0.74 CA12 (0.43) CA12CA1CA9MAPTDNM1
Water SCHEMBL8722192 0.74 CA12 (0.43) CA12CA1CA9MAPTDNM1
Hydrogen Sulfide SCHEMBL11505777 0.74 CA12 (0.43) CA12CA1CA9MAPTDNM1
SCHEMBL1897739 0.74 CA12 (0.43) CA12CA1CA9MAPTDNM1
SCHEMBL11350672 0.74 DNM1 (0.47) CA12CA1CA9MAPTDNM1
Hydrochloric Acid SCHEMBL180393 0.74 DNM1 (0.45) CA12CA1CA9MAPTDNM1

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-116918029-A selective thermal atomic layer deposition 弗萨姆材料美国有限责任公司 2023-10-20 CN disclosed