SCHEMBL4820408

SCHEMBL4820408

C[Si](C)(C)CCOC(=O)NCCCCCCN(C=O)OCc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TGM2 P21980 1/20 0.47
HTT P42858 1/20 0.44
LMNA P02545 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
CHRNB2 P17787 1/20 0.42
CHRNB4 P30926 1/20 0.42
CHRNA3 P32297 1/20 0.42
CHRNA4 P43681 1/20 0.42
KEAP1 Q14145 2/20 0.41
NFE2L2 Q16236 2/20 0.41
HDAC1 Q13547 2/20 0.41
HDAC2 Q92769 2/20 0.41
HDAC8 Q9BY41 2/20 0.41
HDAC6 Q9UBN7 2/20 0.41
FOLH1 Q04609 1/20 0.40
MAPT P10636 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
FAAH O00519 1/20 0.39
BCHE P06276 2/20 0.38
ACHE P22303 2/20 0.38

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
SCHEMBL4827129 0.88 TGM2 (0.60) TGM2HTTLMNASMN1; SMN2KEAP1
SCHEMBL6561783 0.78 HTT (0.53) TGM2HTTLMNASMN1; SMN2CHRNB2
SCHEMBL6563172 0.76 HTT (0.50) TGM2HTTLMNASMN1; SMN2CHRNB2
SCHEMBL14279906 0.76 CTSK (0.48)
SCHEMBL31357179 0.76 HTT (0.59) TGM2HTTLMNASMN1; SMN2KEAP1
SCHEMBL6618522 0.73 MAPT (0.49) HTTSMN1; SMN2HDAC1HDAC2HDAC8
SCHEMBL9879981 0.73 MAPT (0.49) HTTSMN1; SMN2HDAC1HDAC2HDAC8
SCHEMBL7095566 0.73 HDAC2 (0.45) HDAC1HDAC2HDAC8HDAC6L3MBTL1
SCHEMBL7739753 0.73 CCR6 (0.41) HTTSMN1; SMN2HDAC1HDAC2HDAC8
SCHEMBL8989023 0.73 CCR6 (0.41) HTTSMN1; SMN2HDAC1HDAC2HDAC8

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
US-7323596-B2 Antibacterial or antiprotozoal activity: formula (1) formula (2) wherein: Z represents a radical of formula N(OH)CH( .dbd. O) or of formula C( .dbd. O)NH(OH); R1 represents hydrogen, methyl or trifluoromethyl, or, except when Z is a radical of DE NOVO PHARMACEUTICALS LTD. (GB) 2008-01-29 US disclosed
US-20040102491-A1 Antimicrobial agents DE NOVO PHARMACEUTICALS LTD. (GB) 2004-05-27 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040102491-A1 Antimicrobial agents CBR1, CYC1, MRM1 TGM2 2786/4885HTT 3820/4885LMNA 1475/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.