SCHEMBL4293208

SCHEMBL4293208

O=C(Nc1nccs1)c1ccc(NC(=O)C2CCCC2)cc1

nearest known ligand 0.65

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.65
ALDH1A1 P00352 2/20 0.65
TSHR P16473 1/20 0.65
MAPK1 P28482 1/20 0.65
AGER Q15109 1/20 0.64
SCN3A Q9NY46 1/20 0.62
ADORA2A P29274 6/20 0.60
MEN1 O00255 2/20 0.60
KMT2A Q03164 2/20 0.60
CYP2C19 P33261 1/20 0.58
NPC1 O15118 5/20 0.58
RAB9A P51151 5/20 0.58
LMNA P02545 1/20 0.58
RECQL P46063 1/20 0.58
L3MBTL1 Q9Y468 1/20 0.58
CYP2C9 P11712 1/20 0.56
MAPT P10636 1/20 0.56
HSD17B10 Q99714 1/20 0.56

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
SCHEMBL17404960 0.85 NPC1 (0.68) SMN1; SMN2ALDH1A1TSHRMAPK1MEN1
SCHEMBL8013302 0.84 NPC1 (0.67) SMN1; SMN2TSHRMAPK1MEN1KMT2A
SCHEMBL4286580 0.82 EPHX2 (0.73) SMN1; SMN2ALDH1A1TSHRAGERSCN3A
Cycloheptane SCHEMBL5500214 0.82 AGER (0.71) SMN1; SMN2ALDH1A1TSHRAGERSCN3A
SCHEMBL4289116 0.82 RAB9A (0.54) SMN1; SMN2ALDH1A1TSHRMAPK1ADORA2A
SCHEMBL4286514 0.82 ADORA2A (0.61) SMN1; SMN2ALDH1A1TSHRMAPK1ADORA2A
SCHEMBL4289814 0.82 ADORA2A (0.61) SMN1; SMN2ALDH1A1TSHRMAPK1ADORA2A
SCHEMBL4287595 0.82 ADORA2A (0.62) SMN1; SMN2ALDH1A1MAPK1ADORA2AMEN1
SCHEMBL4286358 0.81 EPHX2 (0.71) SMN1; SMN2ALDH1A1TSHRAGERSCN3A
SCHEMBL4291950 0.81 EPHX2 (0.71) SMN1; SMN2ALDH1A1TSHRAGERSCN3A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090247593-A1 N-THIAZOL-2-YL-BENZAMIDE DERIVATIVES H. LUNDBECK A/S (DK) 2009-10-01 US claimed
EP-1803455-A1 N-thiazol-2-yl-benzamide derivatives H.Lundbeck A/S (DK) 2007-07-04 EP claimed
EP-1682129-B1 N-THIAZOL-2-YL-BENZAMIDE DERIVATIVES LUNDBECK & CO AS H (DK) 2007-02-21 EP claimed
EP-1682129-A1 N-THIAZOL-2-YL-BENZAMIDE DERIVATIVES H. LUNDBECK A/S (DK) 2006-07-26 EP claimed
US-20060154974-A1 N-thiazol-2-yl-benzamide derivatives H. LUNDBECK A/S (DK) 2006-07-13 US claimed
WO-2005039572-A1 N-THIAZOL-2-YL-BENZAMIDE DERIVATIVES H. LUNDBECK A/S (DK) 2005-05-06 WO claimed
US-20090247593-A1 N-THIAZOL-2-YL-BENZAMIDE DERIVATIVES H. LUNDBECK A/S (DK) 2009-10-01 US disclosed
EP-1803455-A1 N-thiazol-2-yl-benzamide derivatives H.Lundbeck A/S (DK) 2007-07-04 EP disclosed
EP-1682129-B1 N-THIAZOL-2-YL-BENZAMIDE DERIVATIVES LUNDBECK & CO AS H (DK) 2007-02-21 EP disclosed
EP-1682129-A1 N-THIAZOL-2-YL-BENZAMIDE DERIVATIVES H. LUNDBECK A/S (DK) 2006-07-26 EP disclosed
US-20060154974-A1 N-thiazol-2-yl-benzamide derivatives H. LUNDBECK A/S (DK) 2006-07-13 US disclosed
WO-2005039572-A1 N-THIAZOL-2-YL-BENZAMIDE DERIVATIVES H. LUNDBECK A/S (DK) 2005-05-06 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-20090247593-A1 N-THIAZOL-2-YL-BENZAMIDE DERIVATIVES ADORA2A, ADORA3, ADORA1 SMN1; SMN2 1617/4885ALDH1A1 624/4885TSHR 68/4885
US-20060154974-A1 N-thiazol-2-yl-benzamide derivatives ADORA2A, ADORA3, ADORA1 SMN1; SMN2 1617/4885ALDH1A1 624/4885TSHR 68/4885

“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.