SCHEMBL4286244

SCHEMBL4286244

COc1ccc(C(=O)Nc2ccc(C(=O)Nc3nccs3)c(OC)c2)cc1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 7/20 0.72
NPC1 O15118 5/20 0.72
ADORA2A P29274 4/20 0.67
ADORA1 P30542 1/20 0.67
MAPT P10636 3/20 0.62
POLB P06746 2/20 0.62
SMN1; SMN2 Q16637 5/20 0.61
MAPK1 P28482 1/20 0.61
TP53 P04637 2/20 0.61
LMNA P02545 1/20 0.61
TSHR P16473 1/20 0.61
TDP1 Q9NUW8 1/20 0.60
ALDH1A1 P00352 2/20 0.58
CYP3A4 P08684 1/20 0.57
CYP2C19 P33261 1/20 0.57
HSD17B10 Q99714 1/20 0.57
BRD4 O60885 1/20 0.57
AGER Q15109 1/20 0.56
KCNMA1 Q12791 1/20 0.55
MEN1 O00255 1/20 0.55

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
SCHEMBL4299253 0.92 ADORA2A (0.67) RAB9ANPC1ADORA2AADORA1MAPT
SCHEMBL16073069 0.86 RAB9A (0.72) RAB9ANPC1ADORA2AADORA1MAPT
SCHEMBL28478360 0.85 RAB9A (1.00) RAB9ANPC1ADORA2AMAPTSMN1; SMN2
SCHEMBL4286353 0.84 ADORA2A (0.73) RAB9ANPC1ADORA2AMAPTPOLB
SCHEMBL4290662 0.83 ADORA2A (0.69) RAB9ANPC1ADORA2AADORA1MAPT
SCHEMBL3191373 0.83 ADORA2A (0.69) RAB9ANPC1ADORA2AADORA1MAPT
SCHEMBL4297591 0.82 GRM4 (0.69) RAB9ANPC1ADORA2AADORA1MAPT
SCHEMBL2753283 0.81 RAB9A (0.92) RAB9ANPC1ADORA2AMAPTSMN1; SMN2
SCHEMBL4286248 0.81 RAB9A (0.72) RAB9ANPC1ADORA2AADORA1MAPT
SCHEMBL4290324 0.80 ADORA2A (0.74) RAB9ANPC1ADORA2AADORA1MAPT

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 RAB9A 2380/4885NPC1 1022/4885ADORA2A 1/4885
US-20060154974-A1 N-thiazol-2-yl-benzamide derivatives ADORA2A, ADORA3, ADORA1 RAB9A 2380/4885NPC1 1022/4885ADORA2A 1/4885

“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.