SCHEMBL1980876

SCHEMBL1980876

CCN(CC)CCCS(=O)(=O)Cl

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.41
USP2 O75604 1/20 0.33
APAF1 O14727 1/20 0.33
NPC1 O15118 1/20 0.33
MITF O75030 1/20 0.33
NSD2 O96028 1/20 0.33
MAPT P10636 1/20 0.33
RAB9A P51151 1/20 0.33
PAOX Q6QHF9 1/20 0.32
LMNA P02545 1/20 0.32
ALDH1A1 P00352 1/20 0.32
SIGMAR1 Q99720 3/20 0.31
KDM4E B2RXH2 1/20 0.31
SLC2A1 P11166 1/20 0.31

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
SCHEMBL14854988 0.85 NPSR1 (0.35) NPSR1SIGMAR1
SCHEMBL21664697 0.77 NPSR1 (0.41) NPSR1USP2PAOXLMNAALDH1A1
SCHEMBL20754833 0.77 MAOB (0.52) KDM4E
SCHEMBL918207 0.76 NPSR1 (0.50) NPSR1USP2PAOXLMNAALDH1A1
SCHEMBL3903877 0.76 NPSR1 (0.41) NPSR1USP2PAOXLMNAALDH1A1
SCHEMBL3903880 0.76 NPSR1 (0.46) NPSR1USP2PAOXLMNAALDH1A1
SCHEMBL15675036 0.75 ALDH1A1 (0.43) ALDH1A1
Water SCHEMBL21295559 0.74 NPSR1 (0.48) NPSR1USP2PAOXLMNAALDH1A1
Hydrochloric Acid SCHEMBL7099693 0.73 ALDH1A1 (0.41) ALDH1A1
SCHEMBL21664792 0.72 NPSR1 (0.36) NPSR1PAOXALDH1A1SIGMAR1SLC2A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110152232-A1 SULFONAMIDE COMPOUNDS AND USES THEREOF SAUNDERS JEFFREY O 2011-06-23 US disclosed
US-20110152232-A1 SULFONAMIDE COMPOUNDS AND USES THEREOF SAUNDERS JEFFREY O 2011-06-23 US disclosed
US-20110152232-A1 SULFONAMIDE COMPOUNDS AND USES THEREOF SAUNDERS JEFFREY O 2011-06-23 US disclosed
US-7829589-B2 Sulfonamide compounds and uses thereof ELIXIR PHARMACEUTICALS, INC. (US) 2010-11-09 US disclosed
US-7829589-B2 Sulfonamide compounds and uses thereof ELIXIR PHARMACEUTICALS, INC. (US) 2010-11-09 US disclosed
US-7829589-B2 Sulfonamide compounds and uses thereof ELIXIR PHARMACEUTICALS, INC. (US) 2010-11-09 US disclosed
WO-2010104929-A1 SULFONAMIDE CONTAINING COMPOUNDS AND USES THEREOF ELIXIR PHARMACEUTICALS, INC. (US) 2010-09-16 WO disclosed
EP-1893569-A4 SULFONAMIDE COMPOUNDS AND USES THEREOF ELIXIR PHARMACEUTICALS INC (US) 2009-08-05 EP disclosed
WO-2008141189-A1 GHRELIN MODULATING COMPOUNDS AND COMBINATIONS THEREOF ELIXIR PHARMACEUTICALS, INC. (US) 2008-11-20 WO disclosed
WO-2008141189-A1 GHRELIN MODULATING COMPOUNDS AND COMBINATIONS THEREOF ELIXIR PHARMACEUTICALS, INC. (US) 2008-11-20 WO disclosed
EP-1893569-A1 SULFONAMIDE COMPOUNDS AND USES THEREOF Elixir Pharmaceuticals, Inc. (US) 2008-03-05 EP disclosed
US-20070270473-A1 Sulfonamide Compounds and Uses Thereof ELIXIR PHARMACEUTICALS, INC. 2007-11-22 US disclosed
US-20070270473-A1 Sulfonamide Compounds and Uses Thereof ELIXIR PHARMACEUTICALS, INC. 2007-11-22 US disclosed
US-20070270473-A1 Sulfonamide Compounds and Uses Thereof ELIXIR PHARMACEUTICALS, INC. 2007-11-22 US disclosed
US-20060293370-A1 Sulfonamide compounds and uses thereof ELIXIR PHARMACEUTICALS, INC. 2006-12-28 US disclosed
WO-2006135860-A1 SULFONAMIDE COMPOUNDS AND USES THEREOF ELIXIR PHARMACEUTICALS, INC. (US) 2006-12-21 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 (3 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-20060293370-A1 Sulfonamide compounds and uses thereof GHSR, GHRHR, SSTR2 NPSR1 23/4885USP2 1469/4885APAF1 4499/4885
US-20070270473-A1 Sulfonamide Compounds and Uses Thereof GHSR, GHRHR, SSTR2 NPSR1 23/4885USP2 1469/4885APAF1 4499/4885
US-20110152232-A1 SULFONAMIDE COMPOUNDS AND USES THEREOF GHSR, GHRHR, SSTR2 NPSR1 23/4885USP2 1469/4885APAF1 4499/4885

“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.