SCHEMBL8251997

SCHEMBL8251997

CCN(CC)CCCNC(=O)CC(C)C

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
ALDH1A1 P00352 3/20 0.50
GAA P10253 1/20 0.50
KMT2A Q03164 2/20 0.46
HPGD P15428 1/20 0.46
LMNA P02545 3/20 0.46
PAOX Q6QHF9 1/20 0.44
KDM4E B2RXH2 2/20 0.41
MEN1 O00255 1/20 0.41
DNM1 Q05193 1/20 0.40
ALOX15 P16050 1/20 0.40
HDAC3 O15379 1/20 0.39
HDAC4 P56524 1/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC7 Q8WUI4 1/20 0.39
HDAC2 Q92769 1/20 0.39
HDAC10 Q969S8 1/20 0.39
HDAC11 Q96DB2 1/20 0.39
HDAC8 Q9BY41 1/20 0.39

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
SCHEMBL13407923 0.89 SMN1; SMN2 (0.46) TP53SMN1; SMN2ALDH1A1GAAKMT2A
SCHEMBL12935849 0.83 GAA (0.48) ALDH1A1GAAKMT2ALMNAPAOX
SCHEMBL26442666 0.81 DNM1 (0.54) TP53SMN1; SMN2ALDH1A1KMT2AHPGD
SCHEMBL6033392 0.81 MEN1 (0.64) ALDH1A1GAAKMT2ALMNAPAOX
SCHEMBL20340484 0.80 SMN1; SMN2 (0.66) TP53SMN1; SMN2ALDH1A1KMT2AHPGD
SCHEMBL18199495 0.80 SMN1; SMN2 (0.66) TP53SMN1; SMN2ALDH1A1KMT2AHPGD
SCHEMBL5146559 0.79 ALDH1A1 (0.54) ALDH1A1GAAKMT2ALMNAPAOX
SCHEMBL11024881 0.79 ALDH1A1 (0.56) SMN1; SMN2ALDH1A1GAAKMT2ALMNA
SCHEMBL3288269 0.79 DNM1 (0.53) ALDH1A1GAALMNAPAOXDNM1
SCHEMBL4845341 0.79 SMN1; SMN2 (0.59) TP53SMN1; SMN2ALDH1A1KMT2AHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7786122-B2 α-(N-sulfonamido)acetamide derivatives as β-amyloid inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2010-08-31 US disclosed
US-7786122-B2 α-(N-sulfonamido)acetamide derivatives as β-amyloid inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2010-08-31 US disclosed
US-20080085894-A1 ALPHA-(N-SULFONAMIDO)ACETAMIDE DERIVATIVES AS BETA-AMYLOID INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2008-04-10 US disclosed
US-20080085894-A1 ALPHA-(N-SULFONAMIDO)ACETAMIDE DERIVATIVES AS BETA-AMYLOID INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2008-04-10 US disclosed
US-7300936-B2 α-(N-sulfonamido)acetamide derivatives as β-amyloid inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2007-11-27 US disclosed
US-7300936-B2 α-(N-sulfonamido)acetamide derivatives as β-amyloid inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2007-11-27 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-20080085894-A1 ALPHA-(N-SULFONAMIDO)ACETAMIDE DERIVATIVES AS BETA-AMYLOID INHIBITORS APP, APBA1, BACE1 TP53 1793/4885SMN1; SMN2 675/4885ALDH1A1 1197/4885

“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.