SCHEMBL4070543

SCHEMBL4070543

Cn1ccnc1S(=O)(=O)CC#N

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.35
LPO P22079 1/20 0.34
MCL1 Q07820 1/20 0.34
C1S P09871 1/20 0.33
TSHR P16473 1/20 0.33
GAA P10253 1/20 0.33
HTT P42858 1/20 0.33
FDPS P14324 1/20 0.31
RIPK1 Q13546 1/20 0.31
CHRM5 P08912 1/20 0.31
CHRM4 P08173 1/20 0.30

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
SCHEMBL20368151 0.80 HTT (0.41) KDM4ELPOMCL1C1STSHR
Hydrochloric Acid SCHEMBL4002551 0.76 LOXL2 (0.38) KDM4ELPOMCL1C1STSHR
SCHEMBL24866147 0.75 KDM4E (0.39) KDM4ELPOMCL1C1STSHR
SCHEMBL24810086 0.74 TSHR (0.37) KDM4ELPOMCL1C1STSHR
SCHEMBL9219747 0.72 KDM4E (0.38) KDM4ELPOMCL1C1STSHR
Hydrochloric Acid SCHEMBL28316626 0.72 LPO (0.40) KDM4ELPOMCL1C1STSHR
SCHEMBL569909 0.71 LPO (0.43) KDM4ELPOMCL1C1STSHR
SCHEMBL7290517 0.70 KDM4E (0.39) KDM4ELPOMCL1C1SHTT
SCHEMBL9033147 0.70 LPO (0.41) KDM4ELPOMCL1C1STSHR
SCHEMBL5610393 0.70 LPO (0.41) KDM4ELPOMCL1C1STSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1625112-B1 NOVEL COMPOUNDS FOR TREATMENT OF OBESITY HIGH POINT PHARMACEUTICALS LLC (US) 2009-07-22 EP disclosed
US-20070010559-A1 Indole derivatives for use as chemical uncoupler NOVO NORDISK A/S (DK) 2007-01-11 US disclosed
EP-1689710-A1 INDOLE DERIVATIVES FOR USE AS CHEMICAL UNCOUPLER NOVO NORDISK A/S (DK) 2006-08-16 EP disclosed
US-20060128662-A1 Novel compounds for treatment of obesity NOVO NORDISK A/S (DK) 2006-06-15 US disclosed
EP-1625112-A1 NOVEL COMPOUNDS FOR TREATMENT OF OBESITY NOVO NORDISK A/S (DK) 2006-02-15 EP disclosed
WO-2005051908-A1 INDOLE DERIVATIVES FOR USE AS CHEMICAL UNCOUPLER NOVO NORDISK A/S (DK) 2005-06-09 WO disclosed
WO-2004101505-A1 NOVEL COMPOUNDS FOR TREATMENT OF OBESITY NOVO NORDISK A/S (DK) 2004-11-25 WO disclosed
US-5783575-A CENTRAL NERVOUS SYSTEM DISORDERS NOVO NORDISK A/S (DK) 1998-07-21 US disclosed
EP-0843660-A1 HETEROCYCLIC COMPOUNDS, THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 1998-05-27 EP disclosed
US-5696148-A POTENT ANTAGONIST OF METABOTROPIC GLUTAMATE RECEPTORS; TREATING EPILEPSY, PARKINSON'S DISEASE, HUNTINGTON'S DISEASE, BRAIN DISORDER AND ALZHEIMER'S DISEASE NOVO NORDISK A/S (DK) 1997-12-09 US disclosed
WO-1997005109-A1 HETEROCYCLIC COMPOUNDS, THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 1997-02-13 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 (2 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-20070010559-A1 Indole derivatives for use as chemical uncoupler GPR119, IDO2, IDO1 KDM4E 434/4885LPO 2006/4885MCL1 2879/4885
US-20060128662-A1 Novel compounds for treatment of obesity GPR119, FABP4, HSD17B4 KDM4E 1689/4885LPO 1965/4885MCL1 3422/4885

“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.