SCHEMBL4286286

SCHEMBL4286286

CCC(C)CC(=O)Nc1ccc(C(=O)Nc2nccs2)cc1OC

nearest known ligand 0.71

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ ADORA2A P29274 9/20 0.71
▸ ADORA1 P30542 4/20 0.71
▸ SMN1; SMN2 Q16637 4/20 0.63
▸ RAB9A P51151 3/20 0.63
▸ MAPK1 P28482 2/20 0.63
▸ MAPT P10636 2/20 0.55
▸ BRD4 O60885 1/20 0.55
▸ NPC1 O15118 2/20 0.52
▸ ALDH1A1 P00352 3/20 0.52
▸ POLB P06746 1/20 0.52
▸ TDP1 Q9NUW8 1/20 0.52
▸ HPGD P15428 2/20 0.51
▸ MEN1 O00255 2/20 0.51
▸ KMT2A Q03164 2/20 0.51
▸ PDE4B Q07343 1/20 0.48
▸ RECQL P46063 1/20 0.48
▸ HTT P42858 1/20 0.48
▸ CYP2C19 P33261 1/20 0.47
▸ CYP2D6 P10635 1/20 0.47

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
SCHEMBL4286277 0.88 ADORA2A (0.74) ADORA2AADORA1SMN1; SMN2RAB9AMAPK1
SCHEMBL4290916 0.83 ADORA2A (0.72) ADORA2AADORA1SMN1; SMN2RAB9AMAPK1
SCHEMBL3201317 0.83 ADORA2A (1.00) ADORA2AADORA1SMN1; SMN2RAB9AMAPK1
SCHEMBL4286660 0.82 ADORA2A (0.86) ADORA2AADORA1SMN1; SMN2RAB9AMAPK1
SCHEMBL4286432 0.81 ADORA2A (0.72) ADORA2AADORA1SMN1; SMN2RAB9AMAPK1
SCHEMBL4286255 0.81 ADORA2A (0.80) ADORA2ASMN1; SMN2RAB9ANPC1MEN1
SCHEMBL4292645 0.80 ADORA2A (0.71) ADORA2AADORA1SMN1; SMN2RAB9AMAPK1
SCHEMBL4293164 0.80 ADORA2A (0.69) ADORA2AADORA1SMN1; SMN2RAB9AMAPK1
SCHEMBL4290664 0.80 ADORA2A (0.69) ADORA2AADORA1SMN1; SMN2RAB9AMAPK1
SCHEMBL4295170 0.79 ADORA2A (0.76) ADORA2AADORA1SMN1; SMN2RAB9AMAPK1

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 ADORA2A 1/4885ADORA1 3/4885SMN1; SMN2 1617/4885
US-20060154974-A1 N-thiazol-2-yl-benzamide derivatives ADORA2A, ADORA3, ADORA1 ADORA2A 1/4885ADORA1 3/4885SMN1; SMN2 1617/4885

“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.

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