SCHEMBL4075766

SCHEMBL4075766

N#CCS(=O)(=O)N1CCOCC1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.48
CA7 P43166 1/20 0.48
CA14 Q9ULX7 1/20 0.48
GAA P10253 2/20 0.43
HTT P42858 1/20 0.43
LMNA P02545 2/20 0.42
SMN1; SMN2 Q16637 4/20 0.42
TSHR P16473 3/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
ALDH1A1 P00352 2/20 0.39
KDM4E B2RXH2 1/20 0.38
POLB P06746 2/20 0.36
MEN1 O00255 1/20 0.35
MAPT P10636 1/20 0.35
KMT2A Q03164 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
CYP1A2 P05177 1/20 0.34
CYP17A1 P05093 1/20 0.34

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
SCHEMBL4081397 0.80 TSHR (0.39) GAAHTTTSHRALDH1A1KDM4E
SCHEMBL4071033 0.78 CA1 (0.42) GAAHTTTSHRALDH1A1KDM4E
SCHEMBL4250778 0.78 CA1 (0.42) GAAHTTTSHRALDH1A1KDM4E
SCHEMBL7157586 0.75 CYP17A1 (0.34) CYP17A1
SCHEMBL7602303 0.75 CA12 (0.59) CA12CA7CA14LMNASMN1; SMN2
SCHEMBL15693585 0.75 CA12 (0.59) CA12CA7CA14GAALMNA
SCHEMBL15693604 0.75 CA12 (0.59) CA12CA7CA14GAALMNA
SCHEMBL1446072 0.71 CA12 (0.54) CA12CA7CA14GAALMNA
SCHEMBL16373413 0.71 CA12 (0.54) CA12CA7CA14GAALMNA
SCHEMBL3591619 0.71 CA12 (0.54) CA12CA7CA14GAALMNA

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 CA12 4756/4885CA7 3734/4885CA14 4620/4885

“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.