SCHEMBL6538722

SCHEMBL6538722

CC(C)(C)OC(=O)N1CCC(CCC(=O)N2CCC[C@@H](C(=O)O)C2)CC1

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.52
ITGB3 P05106 15/20 0.52
ITGA2B P08514 15/20 0.52
F2R P25116 12/20 0.52
ALDH1A1 P00352 2/20 0.51
MEN1 O00255 1/20 0.51
MAPT P10636 1/20 0.51
KMT2A Q03164 1/20 0.51
HSD17B10 Q99714 1/20 0.46

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
SCHEMBL7501858 1.00 HPGD (0.52) HPGDITGB3ITGA2BF2RALDH1A1
SCHEMBL6538726 1.00 HPGD (0.52) HPGDITGB3ITGA2BF2RALDH1A1
SCHEMBL7496179 0.94 HPGD (0.52) HPGDITGB3ITGA2BF2RALDH1A1
SCHEMBL27962065 0.89 HPGD (0.51) HPGDITGB3ITGA2BF2RALDH1A1
SCHEMBL27961946 0.87 ITGB3 (0.52) HPGDITGB3ITGA2BF2RALDH1A1
SCHEMBL28917182 0.86 ALDH1A1 (0.56) HPGDITGB3ITGA2BF2RALDH1A1
SCHEMBL28917184 0.86 ALDH1A1 (0.56) HPGDITGB3ITGA2BF2RALDH1A1
SCHEMBL7500093 0.86 ITGB3 (0.74) ITGB3ITGA2BF2R
SCHEMBL7501631 0.86 ITGB3 (0.74) ITGB3ITGA2BF2R
SCHEMBL23897836 0.85 MEN1 (0.52) HPGDITGB3ITGA2BF2RALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115515647-A Radiopharmaceuticals and compositions for thrombus imaging 财团法人峨山社会福祉财团 2022-12-23 CN disclosed
CN-115379860-A Stabilizer for radiopharmaceuticals and radiopharmaceutical composition comprising same 财团法人峨山社会福祉财团 2022-11-22 CN disclosed
WO-2021201395-A1 STABILIZING AGENT FOR RADIOPHARMACEUTICAL, AND RADIOPHARMACEUTICAL COMPOSITION COMPRISING SAME 재단법인 아산사회복지재단 2021-10-07 WO disclosed
WO-2021201488-A1 THROMBUS IMAGING RADIOPHARMACEUTICAL AND COMPOSITION 재단법인 아산사회복지재단 2021-10-07 WO disclosed
US-9744252-B2 Compounds for binding to the platelet specific glycoprotein IIb/IIIa and their use for imaging of thrombi PIRAMAL IMAGING SA (CH) 2017-08-29 US disclosed
US-9744252-B2 Compounds for binding to the platelet specific glycoprotein IIb/IIIa and their use for imaging of thrombi PIRAMAL IMAGING SA (CH) 2017-08-29 US disclosed
US-9744252-B2 Compounds for binding to the platelet specific glycoprotein IIb/IIIa and their use for imaging of thrombi PIRAMAL IMAGING SA (CH) 2017-08-29 US disclosed
US-20170008876-A1 Metal Chelate Compounds for Binding to the Platelet Specific Glycoprotein IIb/IIIa BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2017-01-12 US disclosed
EP-2744802-B1 COMPOUNDS FOR BINDING TO THE PLATELET SPECIFIC GLYCOPROTEIN IIB/IIIA AND THEIR USE FOR IMAGING OF THROMBI PIRAMAL IMAGING SA (CH) 2017-01-04 EP disclosed
EP-2744802-B1 COMPOUNDS FOR BINDING TO THE PLATELET SPECIFIC GLYCOPROTEIN IIB/IIIA AND THEIR USE FOR IMAGING OF THROMBI PIRAMAL IMAGING SA (CH) 2017-01-04 EP disclosed
US-6380215-B1 FOR PREVENTION AND/OR TREATMENT OF DISEASES CAUSED BY THROMBUS FORMATION SUCH AS ARTERIAL THROMBOSIS, ARTERIAL SCLEROSIS, ISCHEMIC HEART DISEASES FUJISAWA PHARMACEUTICAL CO., LTD (JP) 2002-04-30 US disclosed
CN-1329595-A Novel process for preparing beta-alanine derivatives FUJIAWA PHARMACEUTICAL CO LTD (JP) 2002-01-02 CN disclosed
US-20010051730-A1 Beta-alanine derivative and a process for the preparation thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-12-13 US disclosed
EP-0669912-B1 N-(3-PIPERIDINYLCARBONYL)-BETA-ALANINE DERIVATIVES AS PAF ANTAGONISTS FUJISAWA PHARMACEUTICAL CO (JP) 2001-12-05 EP disclosed
WO-2001060813-A1 BETA-ALANINE DERIVATIVES AND THEIR USE AS RECEPTOR ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-08-23 WO disclosed
EP-1121346-A1 NEW PROCESSES FOR PRODUCING BETA-ALANINE DERIVATIVE FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-08-08 EP disclosed
EP-1106606-A2 N-(3-piperidinylcarbonyl)-beta-alanine derivatives as paf antagonists FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-06-13 EP disclosed
WO-2000021932-A1 NEW PROCESSES FOR PRODUCING β-ALANINE DERIVATIVE FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-04-20 WO disclosed
EP-0669912-A1 N-(3-PIPERIDINYLCARBONYL)-BETA-ALANINE DERIVATIVES AS PAF ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1995-09-06 EP disclosed
WO-1995008536-A1 N-(3-PIPERIDINYLCARBONYL)-BETA-ALANINE DERIVATIVES AS PAF ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1995-03-30 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-20170008876-A1 Metal Chelate Compounds for Binding to the Platelet Specific Glycoprotein IIb/IIIa GP6, ITGA2B, F13B HPGD 2251/4885ITGB3 5/4885ITGA2B 2/4885
US-20010051730-A1 Beta-alanine derivative and a process for the preparation thereof F13B, FGB, TGFB1 HPGD 1723/4885ITGB3 52/4885ITGA2B 14/4885

“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.