SCHEMBL4295170

SCHEMBL4295170

COc1cc(C(=O)Nc2nccs2)ccc1NC(=O)C(C)(C)C

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 5/20 0.76
ADORA1 P30542 4/20 0.76
RAB9A P51151 7/20 0.71
SMN1; SMN2 Q16637 3/20 0.71
MAPK1 P28482 3/20 0.71
MAPT P10636 3/20 0.62
BRD4 O60885 1/20 0.62
NPC1 O15118 6/20 0.58
POLB P06746 2/20 0.54
TDP1 Q9NUW8 1/20 0.54
MEN1 O00255 3/20 0.53
KMT2A Q03164 3/20 0.53
HPGD P15428 1/20 0.53
ALDH1A1 P00352 2/20 0.52
HTT P42858 1/20 0.52
ESR2 Q92731 1/20 0.52
HSD17B10 Q99714 1/20 0.52
KCNMA1 Q12791 1/20 0.52
TP53 P04637 1/20 0.52
ABL1 P00519 1/20 0.52

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
SCHEMBL3201317 0.86 ADORA2A (1.00) ADORA2AADORA1RAB9ASMN1; SMN2MAPK1
SCHEMBL4286660 0.85 ADORA2A (0.86) ADORA2AADORA1RAB9ASMN1; SMN2MAPK1
SCHEMBL4292574 0.84 RAB9A (0.71) ADORA2AADORA1RAB9ASMN1; SMN2MAPK1
SCHEMBL3188014 0.80 RAB9A (0.79) ADORA2AADORA1RAB9ASMN1; SMN2MAPK1
SCHEMBL4290916 0.80 ADORA2A (0.72) ADORA2AADORA1RAB9ASMN1; SMN2MAPK1
SCHEMBL4286432 0.80 ADORA2A (0.72) ADORA2AADORA1RAB9ASMN1; SMN2MAPK1
SCHEMBL4286277 0.79 ADORA2A (0.74) ADORA2AADORA1RAB9ASMN1; SMN2MAPK1
SCHEMBL4286286 0.79 ADORA2A (0.71) ADORA2AADORA1RAB9ASMN1; SMN2MAPK1
SCHEMBL4292645 0.79 ADORA2A (0.71) ADORA2AADORA1RAB9ASMN1; SMN2MAPK1
SCHEMBL4290664 0.79 ADORA2A (0.69) ADORA2AADORA1RAB9ASMN1; SMN2MAPK1

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-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 ADORA2A 1/4885ADORA1 3/4885RAB9A 2380/4885
US-20060154974-A1 N-thiazol-2-yl-benzamide derivatives ADORA2A, ADORA3, ADORA1 ADORA2A 1/4885ADORA1 3/4885RAB9A 2380/4885

“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.