SCHEMBL13982602

SCHEMBL13982602

NCCCCOc1cccc2c1C(N)=NS(=O)(=O)N2

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SSTR2 P30874 1/20 0.36
SSTR4 P31391 1/20 0.36
HTR1B P28222 2/20 0.35
NCF1 P14598 1/20 0.33
KDM4E B2RXH2 1/20 0.32
KCNA3 P22001 1/20 0.32
MCHR1 Q99705 2/20 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
SCHEMBL10259613 0.99 SSTR2 (0.38) SSTR2SSTR4HTR1BNCF1KDM4E
Hydrochloric Acid SCHEMBL619124 0.97 SSTR2 (0.37) SSTR2SSTR4HTR1BNCF1KDM4E
SCHEMBL2416548 0.89 MCHR1 (0.43) MCHR1
SCHEMBL14767762 0.89 MCHR1 (0.33) NCF1KCNA3MCHR1
SCHEMBL13982508 0.89 NCF1 (0.35) NCF1KCNA3MCHR1
SCHEMBL12322607 0.89 F10 (0.34) NCF1KCNA3MCHR1
SCHEMBL622041 0.88 NCF1 (0.34) NCF1KCNA3MCHR1
SCHEMBL12323396 0.88 NCF1 (0.34) NCF1KCNA3MCHR1
SCHEMBL2417947 0.88 NCF1 (0.34) NCF1KCNA3MCHR1
SCHEMBL12322099 0.88 MCHR1 (0.44) MCHR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2573559-B1 Modulation of chemosensory receptors and ligands associated therewith SENOMYX INC (US) 2019-03-13 EP disclosed
EP-2062050-B1 MODULATION OF CHEMOSENSORY RECEPTORS AND LIGANDS ASSOCIATED THEREWITH SENOMYX INC (US) 2016-05-18 EP disclosed
US-9181276-B2 Modulation of chemosensory receptors and ligands associated therewith SENOMYX, INC. (US) 2015-11-10 US disclosed
US-20140235623-A1 MODULATION OF CHEMOSENSORY RECEPTORS AND LIGANDS ASSOCIATED THEREWITH SENOMYX, INC. (US) 2014-08-21 US disclosed
US-8633186-B2 Modulation of chemosensory receptors and ligands associated therewith SENOMYX INC. (US) 2014-01-21 US disclosed
EP-2573559-A1 Modulation of chemosensory receptors and ligands associated Senomyx, Inc. (US) 2013-03-27 EP disclosed
EP-2568287-A2 Modulation of chemosensory receptors and ligands associated Senomyx, Inc. (US) 2013-03-13 EP disclosed
WO-2008154221-A2 MODULATION OF CHEMOSENSORY RECEPTORS AND LIGANDS ASSOCIATED THEREWITH SENOMYX, INC. (US) 2008-12-18 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-20140235623-A1 MODULATION OF CHEMOSENSORY RECEPTORS AND LIGANDS ASSOCIATED THEREWITH TAS2R30, TAS2R50, TAS2R1 SSTR2 302/4885SSTR4 263/4885HTR1B 833/4885

“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.