SCHEMBL5720428

SCHEMBL5720428

Nc1nc2c(s1)CC(=O)CC2

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APOBEC3A P31941 1/20 0.52
APOBEC3G Q9HC16 1/20 0.52
ALDH1A1 P00352 3/20 0.43
MAPK1 P28482 2/20 0.43
RAD52 P43351 2/20 0.41
RECQL P46063 1/20 0.41
DRD3 P35462 6/20 0.39
DRD2 P14416 5/20 0.39
MAPT P10636 3/20 0.39
ADRA2A P08913 3/20 0.39
LMNA P02545 2/20 0.39
ADRA2B P18089 2/20 0.39
ADRA2C P18825 2/20 0.39
HTR2A P28223 2/20 0.39
ADRA1A P35348 2/20 0.39
HRH1 P35367 2/20 0.39
OPRK1 P41145 1/20 0.39
HRH3 Q9Y5N1 1/20 0.39
HSD17B10 Q99714 2/20 0.38
KDM4E B2RXH2 1/20 0.38

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
Bromide SCHEMBL5720591 0.98 APOBEC3A (0.50) APOBEC3AAPOBEC3GALDH1A1MAPK1RAD52
SCHEMBL19153815 0.76 DPP4 (0.32)
SCHEMBL8132842 0.76 APOBEC3A (0.52) APOBEC3AAPOBEC3GALDH1A1MAPK1RAD52
SCHEMBL18237620 0.72 GRM5 (0.33) MAPK1RAD52RECQLGAARAB9A
SCHEMBL19131904 0.72 GRM5 (0.33)
SCHEMBL624175 0.70
SCHEMBL558522 0.70 APOBEC3A (0.95) APOBEC3AAPOBEC3GALDH1A1MAPK1RAD52
SCHEMBL27034730 0.68 APOBEC3A (0.43) APOBEC3AAPOBEC3GALDH1A1MAPK1RAD52
Iodide SCHEMBL4937558 0.68 APOBEC3A (0.91) APOBEC3AAPOBEC3GALDH1A1MAPK1RAD52
Hydrochloric Acid SCHEMBL963094 0.68 APOBEC3A (0.83) APOBEC3AAPOBEC3GALDH1A1MAPK1RAD52

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 104 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116178304-B Synthesis method of pramipexole dihydrochloride 中国药科大学 2024-10-25 CN claimed
CN-118239904-A Chiral synthesis method of 2, 6-diamino-4, 5,6, 7-tetrahydrobenzothiazole optical isomer 福建福瑞明德药业有限公司 2024-06-25 CN claimed
CN-116694585-A Application of ketoamine reductase in synthesizing chiral pramipexole and synthetic method 华侨大学 2023-09-05 CN claimed
CN-116178304-A Synthesis method of pramipexole dihydrochloride 中国药科大学 2023-05-30 CN claimed
EP-1318986-B1 PROCESS FOR PREPARATION OF 2-AMINO-6-(ALKYL) AMINO-4,5,6,7-TETRAHYDROBENZOTHIAZOLES SYNTHON BV (NL) 2006-05-31 EP claimed
US-6770761-B2 BROMINATION OF 1,4-CYCLOHEXANEDIONE BY BROMINE IN AN ALCOHOLIC SOLVENT; TREATMENT WITH THIOUREA OR N-ACYLTHIOUREA; ISOMERIZATION, CYCLIZATION; PRAMIPEXOLE SYNTHESIS SYNTHON BV (NL) 2004-08-03 US claimed
US-20040029936-A1 Process for preparation of 2-amino-6 (alkyl) amino-4,5,6,7-tetrahydrobenzothiazoles SYNTHON IP INC. 2004-02-12 US claimed
EP-1318986-A1 PROCESS FOR PREPARATION OF 2-AMINO-6-(ALKYL) AMINO-4,5,6,7-TETRAHYDROBENZOTHIAZOLES Synthon B.V. (NL) 2003-06-18 EP claimed
WO-2002022590-A1 PROCESS FOR PREPARATION OF 2-AMINO-6-(ALKYL) AMINO-4,5,6,7-TETRAHYDROBENZOTHIAZOLES SYNTHON B.V. (NL) 2002-03-21 WO claimed
CN-118239904-B Chiral synthesis method of 2, 6-diamino-4, 5,6, 7-tetrahydrobenzothiazole optical isomer 福建福瑞明德药业有限公司 2025-10-17 CN disclosed
EP-4558494-A1 1,3,4-OXADIAZOLE DERIVATIVES AS SELECTIVE HISTONE DEACETYLASE 6 INHIBITORS ITALFARMACO S.p.A. (IT) 2025-05-28 EP disclosed
CN-119562949-A 1,3, 4-Oxadiazole derivatives as selective histone deacetylase 6 inhibitors 意大发马克股份公司 2025-03-04 CN disclosed
US-20240360114-A1 FERROPTOSIS MODULATORS, PREPARATIONS, AND USES THEREOF Sironax Ltd. (KY) 2024-10-31 US disclosed
CN-116178304-B Synthesis method of pramipexole dihydrochloride 中国药科大学 2024-10-25 CN disclosed
US-20040029936-A1 Process for preparation of 2-amino-6 (alkyl) amino-4,5,6,7-tetrahydrobenzothiazoles SYNTHON IP INC. 2004-02-12 US disclosed
EP-1318986-A1 PROCESS FOR PREPARATION OF 2-AMINO-6-(ALKYL) AMINO-4,5,6,7-TETRAHYDROBENZOTHIAZOLES Synthon B.V. (NL) 2003-06-18 EP disclosed
EP-1318987-A1 PROCESS FOR RESOLUTION OF 2-AMINO-6-PROPYLAMINO-4,5,6,7-TETRAHYDROBENZOTHIAZOLE AND COMPOUNDS THEREFOR Synthon B.V. (NL) 2003-06-18 EP disclosed
US-20020103240-A1 Process for resolution of 2-amino-6-propylamino-4,5,6,7-tetrahydrobenzthiazole and compounds therefor SYNTHON IP INC. 2002-08-01 US disclosed
WO-2002022591-A1 PROCESS FOR RESOLUTION OF 2-AMINO-6-PROPYLAMINO-4,5,6,7-TETRAHYDROBENZOTHIAZOLE AND COMPOUNDS THEREFOR SYNTHON B.V. (NL) 2002-03-21 WO disclosed
WO-2002022590-A1 PROCESS FOR PREPARATION OF 2-AMINO-6-(ALKYL) AMINO-4,5,6,7-TETRAHYDROBENZOTHIAZOLES SYNTHON B.V. (NL) 2002-03-21 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 (3 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-20020103240-A1 Process for resolution of 2-amino-6-propylamino-4,5,6,7-tetrahydrobenzthiazole and compounds therefor NOTUM, SLC5A6, WEE2 APOBEC3A 4792/4885APOBEC3G 4669/4885ALDH1A1 3519/4885
US-20240360114-A1 FERROPTOSIS MODULATORS, PREPARATIONS, AND USES THEREOF AIFM2, GPX1, GPX4 APOBEC3A 4192/4885APOBEC3G 3833/4885ALDH1A1 1441/4885
US-20040029936-A1 Process for preparation of 2-amino-6 (alkyl) amino-4,5,6,7-tetrahydrobenzothiazoles PAH, HTR6, HTR4 APOBEC3A 3850/4885APOBEC3G 3502/4885ALDH1A1 2236/4885

“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.