SCHEMBL4295367

SCHEMBL4295367

CC(=O)Nc1ccc(C(=O)Nc2nccs2)c(C)c1

nearest known ligand 0.71

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 7/20 0.71
AGER Q15109 2/20 0.70
CYP2C19 P33261 2/20 0.63
CYP3A4 P08684 1/20 0.63
RAB9A P51151 5/20 0.56
NPC1 O15118 4/20 0.56
SMN1; SMN2 Q16637 2/20 0.56
PPARG P37231 1/20 0.56
NCOR2 Q9Y618 1/20 0.56
ADORA1 P30542 1/20 0.53
MEN1 O00255 1/20 0.52
KMT2A Q03164 1/20 0.52
KDM4E B2RXH2 1/20 0.52
CYP1A2 P05177 1/20 0.51
HPGD P15428 1/20 0.51
ALDH1A1 P00352 2/20 0.50
GAA P10253 1/20 0.50
HSD17B10 Q99714 1/20 0.50

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
SCHEMBL16073054 0.84 NPC1 (0.69) ADORA2ACYP2C19CYP3A4RAB9ANPC1
SCHEMBL4292883 0.83 ADORA2A (1.00) ADORA2AAGERCYP2C19CYP3A4RAB9A
SCHEMBL16603980 0.82 AGER (1.00) ADORA2AAGERCYP2C19CYP3A4RAB9A
SCHEMBL4295738 0.82 NPC1 (0.66) ADORA2ACYP2C19CYP3A4RAB9ANPC1
SCHEMBL27664703 0.80 ADORA2A (0.60) ADORA2AAGERCYP2C19CYP3A4RAB9A
SCHEMBL16073082 0.80 RAB9A (0.70) ADORA2ACYP2C19CYP3A4RAB9ANPC1
SCHEMBL4290956 0.79 ADORA2A (0.72) ADORA2ACYP2C19CYP3A4RAB9ANPC1
SCHEMBL24072353 0.78 CYP3A4 (0.81) ADORA2ACYP2C19CYP3A4RAB9ANPC1
SCHEMBL30339046 0.78 CYP3A4 (0.81) ADORA2ACYP2C19CYP3A4RAB9ANPC1
SCHEMBL4290662 0.77 ADORA2A (0.69) ADORA2AAGERCYP2C19CYP3A4RAB9A

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 6 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 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 ADORA2A 1/4885AGER 824/4885CYP2C19 1411/4885
US-20060154974-A1 N-thiazol-2-yl-benzamide derivatives ADORA2A, ADORA3, ADORA1 ADORA2A 1/4885AGER 824/4885CYP2C19 1411/4885

“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.