SCHEMBL6399271

SCHEMBL6399271

CCN(CC)C(=O)/N=N/C(=O)N(CC)CC

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.45
TSHR P16473 3/20 0.45
NFKB1 P19838 2/20 0.45
THPO P40225 2/20 0.45
HSD17B10 Q99714 2/20 0.45
MAPT P10636 2/20 0.45
PMP22 Q01453 2/20 0.45
APEX1 P27695 1/20 0.45
LMNA P02545 3/20 0.43
MMP1 P03956 1/20 0.42
MMP2 P08253 1/20 0.42
MMP3 P08254 1/20 0.42
MMP8 P22894 1/20 0.42
CA12 O43570 3/20 0.36
CA1 P00915 3/20 0.36
CA9 Q16790 3/20 0.36
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36
EHMT2 Q96KQ7 3/20 0.35
EHMT1 Q9H9B1 3/20 0.35

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
SCHEMBL2678230 1.00 ALDH1A1 (0.45) ALDH1A1TSHRNFKB1THPOHSD17B10
SCHEMBL8095687 0.87 ALDH1A1 (0.48) ALDH1A1TSHRNFKB1THPOHSD17B10
SCHEMBL409740 0.79
SCHEMBL969220 0.77 LMNA (0.40) ALDH1A1TSHRNFKB1THPOHSD17B10
SCHEMBL6701758 0.77
SCHEMBL28641134 0.75 LMNA (0.44) LMNAMMP1MMP2MMP3MMP8
SCHEMBL11583751 0.73 LMNA (0.37) ALDH1A1TSHRNFKB1THPOHSD17B10
SCHEMBL24394654 0.71 LMNA (0.36) LMNAMMP1MMP2MMP3MMP8
SCHEMBL5825136 0.71 LMNA (0.36) ALDH1A1TSHRNFKB1THPOHSD17B10
SCHEMBL26934079 0.71 LMNA (0.36) ALDH1A1MAPTLMNAMMP1MMP2

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
US-20050288376-A1 Bicyclyl or heterobicyclylmethanesulfonylanimo-substituted N-hydroxyformamides SMITHKLINE BEECHAM PLC 2005-12-29 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-20050288376-A1 Bicyclyl or heterobicyclylmethanesulfonylanimo-substituted N-hydroxyformamides CD22, CD2, NEU3 ALDH1A1 945/4885TSHR 921/4885NFKB1 3074/4885

“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.