SCHEMBL1168786

SCHEMBL1168786

CCCCC(CCCC)[C@H](N)CO

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 4/20 0.54
MAPT P10636 4/20 0.54
LMNA P02545 4/20 0.54
SPHK1 Q9NYA1 4/20 0.54
GMNN O75496 3/20 0.54
POLB P06746 3/20 0.54
BLM P54132 3/20 0.54
CETP P11597 3/20 0.54
UBE2N P61088 3/20 0.54
TP53 P04637 3/20 0.54
THPO P40225 2/20 0.54
CYP1A2 P05177 2/20 0.54
MTOR P42345 1/20 0.54
KDM4E B2RXH2 1/20 0.54
CYP3A4 P08684 1/20 0.54
HTT P42858 1/20 0.54
ALDH1A1 P00352 3/20 0.46
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
GLA P06280 2/20 0.41

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
SCHEMBL21549711 0.91 LMNA (0.50) CYP2D6MAPTLMNASPHK1GMNN
SCHEMBL29092693 0.84 LMNA (0.46) CYP2D6MAPTLMNASPHK1GMNN
SCHEMBL11590828 0.84 LMNA (0.46) CYP2D6MAPTLMNASPHK1GMNN
SCHEMBL465390 0.84 LMNA (0.59) CYP2D6MAPTLMNASPHK1GMNN
SCHEMBL9550799 0.83 LMNA (0.47) CYP2D6MAPTLMNASPHK1GMNN
SCHEMBL11897247 0.81 OPRM1 (0.43) CYP2D6MAPTLMNASPHK1GMNN
SCHEMBL14702968 0.81 ALDH1A1 (0.48) CYP2D6MAPTLMNASPHK1GMNN
SCHEMBL3837397 0.80 ALDH1A1 (0.46) CYP2D6MAPTLMNASPHK1GMNN
SCHEMBL28919262 0.79 LMNA (0.39) CYP2D6MAPTLMNASPHK1GMNN
SCHEMBL5371282 0.79 ALDH1A1 (0.44) CYP2D6MAPTLMNASPHK1GMNN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110034513-A1 Heterocyclic Sulfonamide Inhibitors of Beta Amyloid Production WYETH LLC (US) 2011-02-10 US disclosed
US-7842718-B2 Heterocyclic sulfonamide inhibitors of beta amyloid production WYETH LLC (US) 2010-11-30 US disclosed
US-7691884-B2 Heterocyclic sulfonamide inhibitors of β amyloid production WYETH (US) 2010-04-06 US disclosed
US-20100022594-A1 HETEROCYCLIC SULFONAMIDE INHIBITORS OF BETA AMYLOID PRODUCTION WYETH (US) 2010-01-28 US disclosed
EP-1341779-B1 HETEROCYCLIC SULFONAMIDE INHIBITORS OF BETA AMYLOID PRODUCTION WYETH CORP (US) 2006-06-21 EP disclosed
US-20050196813-A1 Heterocyclic sulfonamide inhibitors of beta amyloid production WYETH (US) 2005-09-08 US disclosed
US-6878742-B2 Heterocyclic sulfonamide inhibitors of beta amyloid production WYETH (US) 2005-04-12 US disclosed
US-20030229127-A1 Heterocyclic sulfonamide inhibitors of beta amyloid production WYETH 2003-12-11 US disclosed
EP-1341779-A2 HETEROCYCLIC SULFONAMIDE INHIBITORS OF BETA AMYLOID PRODUCTION Wyeth (US) 2003-09-10 EP disclosed
US-6610734-B2 For therapy of Alzheimer's Disease and Down's syndrome WYETH 2003-08-26 US disclosed
US-20020183361-A1 Heterocyclic sulfonamide inhibitors of beta amyloid production ARQULE 2002-12-05 US disclosed
WO-2002057252-A2 HETEROCYCLIC SULFONAMIDE INHIBITORS OF BETA AMYLOID PRODUCTION WYETH (US) 2002-07-25 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 (4 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-20030229127-A1 Heterocyclic sulfonamide inhibitors of beta amyloid production APP, BACE1, PSEN1 CYP2D6 783/4885MAPT 19/4885LMNA 1273/4885
US-20100022594-A1 HETEROCYCLIC SULFONAMIDE INHIBITORS OF BETA AMYLOID PRODUCTION APP, BACE1, PSEN1 CYP2D6 1351/4885MAPT 26/4885LMNA 1423/4885
US-20110034513-A1 Heterocyclic Sulfonamide Inhibitors of Beta Amyloid Production APP, BACE1, PSEN1 CYP2D6 1351/4885MAPT 26/4885LMNA 1423/4885
US-20020183361-A1 Heterocyclic sulfonamide inhibitors of beta amyloid production APP, BACE1, PSEN1 CYP2D6 783/4885MAPT 19/4885LMNA 1273/4885

“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.