SCHEMBL1620804

SCHEMBL1620804

Cc1cccc(NC(=S)NC(=O)c2ccccc2)c1C#N

nearest known ligand 0.71

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 2/20 0.71
RAB9A P51151 5/20 0.60
NPC1 O15118 3/20 0.60
NPSR1 Q6W5P4 2/20 0.60
L3MBTL1 Q9Y468 2/20 0.60
ALDH1A1 P00352 8/20 0.56
MAPT P10636 6/20 0.56
RXFP1 Q9HBX9 1/20 0.56
MEN1 O00255 5/20 0.55
KMT2A Q03164 5/20 0.55
ALOX12 P18054 2/20 0.55
TDP1 Q9NUW8 1/20 0.55
KDM4E B2RXH2 3/20 0.54
HPGD P15428 2/20 0.54
POLB P06746 2/20 0.53
GLA P06280 1/20 0.53
GAA P10253 1/20 0.53

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
SCHEMBL1622084 0.87 RAB9A (0.55) EPHX1RAB9ANPC1NPSR1L3MBTL1
SCHEMBL6823406 0.86 HPGD (0.66) EPHX1RAB9ANPC1ALDH1A1MAPT
SCHEMBL5713527 0.83 EPHX1 (1.00) EPHX1RAB9ANPC1NPSR1L3MBTL1
SCHEMBL8612464 0.81 EPHX1 (0.77) EPHX1RAB9ANPC1NPSR1L3MBTL1
SCHEMBL9686610 0.80 EPHX1 (0.76) EPHX1RAB9ANPC1NPSR1L3MBTL1
SCHEMBL31389407 0.80 EPHX1 (0.76) EPHX1RAB9ANPC1NPSR1L3MBTL1
SCHEMBL1622164 0.80 KMT2A (0.66) EPHX1RAB9ANPC1NPSR1L3MBTL1
SCHEMBL22979909 0.79 RAB9A (0.44) RAB9ANPC1NPSR1ALDH1A1MAPT
SCHEMBL6118209 0.79 EPHX1 (0.78) EPHX1RAB9ANPC1NPSR1L3MBTL1
SCHEMBL11171176 0.79 EPHX1 (0.78) EPHX1RAB9ANPC1NPSR1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110115365-A The adjusting that actinism receptor and relative ligand are carried out 西诺米克斯公司 2019-08-13 CN disclosed
EP-2573559-B1 Modulation of chemosensory receptors and ligands associated therewith SENOMYX INC (US) 2019-03-13 EP disclosed
US-9603848-B2 Modulation of chemosensory receptors and ligands associated therewith SENOMYX, INC. (US) 2017-03-28 US 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
US-8541421-B2 Methods of enhancing sweet taste of compositions using substituted thieno{2,3-D}pyrimidines SENOMYX INC. (US) 2013-09-24 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
US-20110230502-A1 MODULATION OF CHEMOSENSORY RECEPTORS AND LIGANDS ASSOCIATED THEREWITH SENOMYX, INC. (US) 2011-09-22 US disclosed
US-20110224155-A1 MODULATION OF CHEMOSENSORY RECEPTORS AND LIGANDS ASSOCIATED THEREWITH SENOMYX INC. (US) 2011-09-15 US disclosed
US-7928111-B2 Compounds including substituted thienopyrimidinone derivatives as ligands for modulating chemosensory receptors SENOMYX, INC. (US) 2011-04-19 US disclosed
EP-2062050-A2 MODULATION OF CHEMOSENSORY RECEPTORS AND LIGANDS ASSOCIATED THEREWITH Senomyx, Inc. (US) 2009-05-27 EP disclosed
WO-2008154221-A2 MODULATION OF CHEMOSENSORY RECEPTORS AND LIGANDS ASSOCIATED THEREWITH SENOMYX, INC. (US) 2008-12-18 WO disclosed
US-20080306053-A1 MODULATION OF CHEMOSENSORY RECEPTORS AND LIGANDS ASSOCIATED THEREWITH SENOMYX, INC. (US) 2008-12-11 US disclosed
US-20080306093-A1 MODULATION OF CHEMOSENSORY RECEPTORS AND LIGANDS ASSOCIATED THEREWITH SENOMYX, INC. (US) 2008-12-11 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 (5 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-20110230502-A1 MODULATION OF CHEMOSENSORY RECEPTORS AND LIGANDS ASSOCIATED THEREWITH OR51E2, TAS2R50, TAS2R30 EPHX1 4057/4885RAB9A 3534/4885NPC1 3785/4885
US-20080306093-A1 MODULATION OF CHEMOSENSORY RECEPTORS AND LIGANDS ASSOCIATED THEREWITH OR51E2, TAS2R50, TAS2R30 EPHX1 4057/4885RAB9A 3534/4885NPC1 3785/4885
US-20140235623-A1 MODULATION OF CHEMOSENSORY RECEPTORS AND LIGANDS ASSOCIATED THEREWITH TAS2R30, TAS2R50, TAS2R1 EPHX1 4470/4885RAB9A 3040/4885NPC1 2949/4885
US-20080306053-A1 MODULATION OF CHEMOSENSORY RECEPTORS AND LIGANDS ASSOCIATED THEREWITH OR51E2, TAS2R50, TAS2R30 EPHX1 4057/4885RAB9A 3534/4885NPC1 3785/4885
US-20110224155-A1 MODULATION OF CHEMOSENSORY RECEPTORS AND LIGANDS ASSOCIATED THEREWITH TAS2R30, TAS2R50, TAS2R1 EPHX1 4470/4885RAB9A 3040/4885NPC1 2949/4885

“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.