SCHEMBL4079671

SCHEMBL4079671

N#CCS(=O)(=O)c1ccc(Cl)cn1

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.37
NAMPT P43490 3/20 0.36
TRPV4 Q9HBA0 5/20 0.36
PKM P14618 2/20 0.36
PPARD Q03181 1/20 0.36
ALDH1A1 P00352 1/20 0.36
MAPT P10636 1/20 0.36
NFE2L2 Q16236 1/20 0.35
JAK2 O60674 1/20 0.34
JAK1 P23458 1/20 0.34
TYK2 P29597 1/20 0.34
JAK3 P52333 1/20 0.34
POLB P06746 2/20 0.34
RAB9A P51151 1/20 0.34
CYP3A4 P08684 1/20 0.33
KCNH2 Q12809 1/20 0.33
RIPK1 Q13546 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL19868461 0.78 KDM4E (0.41) KDM4ENAMPTPPARDNFE2L2JAK2
SCHEMBL1657082 0.78 KDM4E (0.41) KDM4EPPARDALDH1A1NFE2L2JAK2
SCHEMBL424168 0.74 PPARD (0.42) KDM4ENAMPTPPARDNFE2L2JAK2
SCHEMBL2646780 0.74 PPARD (0.42) KDM4EPPARDALDH1A1NFE2L2JAK2
SCHEMBL3247012 0.74 ALDH1A1 (0.50) KDM4EALDH1A1CYP3A4
SCHEMBL4081435 0.71 NFE2L2 (0.48) KDM4ENAMPTPKMALDH1A1MAPT
SCHEMBL1465207 0.71 NFE2L2 (0.42) KDM4ENAMPTPKMALDH1A1NFE2L2
SCHEMBL11185099 0.71 ALDH1A1 (0.54) KDM4EALDH1A1MAPTPOLBRAB9A
SCHEMBL2704697 0.70 CA1 (0.61) KDM4ENFE2L2POLB
SCHEMBL2645976 0.70 NFE2L2 (0.41) KDM4ENFE2L2POLB

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 4 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-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-2004101505-A1 NOVEL COMPOUNDS FOR TREATMENT OF OBESITY NOVO NORDISK A/S (DK) 2004-11-25 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 (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-20060128662-A1 Novel compounds for treatment of obesity GPR119, FABP4, HSD17B4 KDM4E 1689/4885NAMPT 1860/4885TRPV4 1667/4885

“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.