SCHEMBL990335

SCHEMBL990335

CCCCCCc1ccc(S(=O)(=O)NCCCCCCN=C=O)cc1

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.57
HTT P42858 4/20 0.57
SMN1; SMN2 Q16637 2/20 0.57
TSHR P16473 1/20 0.52
ALOX12 P18054 1/20 0.50
MAPK1 P28482 1/20 0.46
CA2 P00918 1/20 0.46
ALDH1A1 P00352 3/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
L3MBTL1 Q9Y468 1/20 0.45

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
SCHEMBL991628 1.00 LMNA (0.57) LMNAHTTSMN1; SMN2TSHRALOX12
SCHEMBL991824 0.83 MEN1 (0.54) LMNAHTTSMN1; SMN2TSHRMAPK1
SCHEMBL992887 0.83 MEN1 (0.54) LMNAHTTSMN1; SMN2TSHRMAPK1
SCHEMBL992813 0.83 MEN1 (0.54) LMNAHTTSMN1; SMN2TSHRMAPK1
SCHEMBL38662090 0.83 LMNA (0.74) LMNAHTTSMN1; SMN2TSHRALOX12
SCHEMBL38664926 0.83 LMNA (0.74) LMNAHTTSMN1; SMN2TSHRALOX12
SCHEMBL38662674 0.83 LMNA (0.74) LMNAHTTSMN1; SMN2TSHRALOX12
SCHEMBL38662567 0.83 LMNA (0.74) LMNAHTTSMN1; SMN2TSHRALOX12
SCHEMBL990936 0.82 MEN1 (0.55) LMNAHTTSMN1; SMN2TSHRMAPK1
SCHEMBL10930325 0.81 LMNA (0.72) LMNAHTTSMN1; SMN2TSHRALOX12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011140009-A1 METHODS OF USING SEMI-SYNTHETIC GLYCOPEPTIDES AS ANTIBACTERIAL AGENTS BIOMARIN PHARMACEUTICAL INC. (US) 2011-11-10 WO disclosed
EP-2373694-A1 NOVEL SEMI-SYNTHETIC GLYCOPEPTIDES AS ANTIBACTERIAL AGENTS BioMarin Pharmaceutical Inc. (US) 2011-10-12 EP disclosed
US-20110015119-A1 NOVEL SEMI-SYNTHETIC GLYCOPEPTIDES AS ANTIBACTERIAL AGENTS LEAD THERAPEUTICS, INC. (US) 2011-01-20 US disclosed
WO-2010065174-A1 NOVEL SEMI-SYNTHETIC GLYCOPEPTIDES AS ANTIBACTERIAL AGENTS LEAD THERAPEUTICS, INC. (US) 2010-06-10 WO 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-20110015119-A1 NOVEL SEMI-SYNTHETIC GLYCOPEPTIDES AS ANTIBACTERIAL AGENTS SI, FUT6, B3GAT3 LMNA 4204/4885HTT 3423/4885SMN1; SMN2 4642/4885

“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.