SCHEMBL472206

SCHEMBL472206

O=CN1CCNCCNCCNCC1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 1/20 0.35
MAPT P10636 1/20 0.35
PDE4A P27815 1/20 0.35
KDR P35968 1/20 0.35
CA2 P00918 2/20 0.33
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA9 Q16790 1/20 0.33
SIGMAR1 Q99720 2/20 0.32
ADRB1 P08588 2/20 0.32
CHKA P35790 1/20 0.32
KDM4E B2RXH2 1/20 0.32
HTR3E A5X5Y0 1/20 0.32
HTR3B O95264 1/20 0.32
HTR3A P46098 1/20 0.32
HTR3D Q70Z44 1/20 0.32
HTR3C Q8WXA8 1/20 0.32
HSD17B10 Q99714 1/20 0.31
CHRNB2 P17787 1/20 0.31
CHRNA3 P32297 1/20 0.31

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
SCHEMBL24672240 1.00 HIF1A (0.35) HIF1AMAPTPDE4AKDRCA2
SCHEMBL12671511 0.97 CA2 (0.35) CA2CA12CA1CA9SIGMAR1
SCHEMBL8467 0.97
SCHEMBL930605 0.97
SCHEMBL10578128 0.97 CA2 (0.35) CA2CA12CA1CA9SIGMAR1
Hydrochloric Acid SCHEMBL1739117 0.94
SCHEMBL16667767 0.94
Hydrochloric Acid SCHEMBL17560377 0.94 CA2 (0.33) CA2CA12CA1CA9SIGMAR1
SCHEMBL1678682 0.94 CA2 (0.37) CA2CA12CA1CA9SIGMAR1
SCHEMBL3881127 0.94 CA2 (0.33) CA2CA12CA1CA9SIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0988305-A1 A PROCESS FOR THE PREPARATION OF 5H,9bH-2a, 4a,7,9a-OCTAHYDROTETRAAZACYCLOOCTA cd]PENTALENE BRACCO INTERNATIONAL B.V. (NL) 2000-03-29 EP claimed
WO-1998056791-A1 A PROCESS FOR THE PREPARATION OF 5H,9bH-2a, 4a,7,9a-OCTAHYDROTETRAAZACYCLOOCTA [cd]PENTALENE BRACCO S.P.A. (IT) 1998-12-17 WO claimed
US-5674470-A Method for imaging mammalian tissue using 1-substituted- 4,7,10-tricarboxymethyl-1,4,7,10-tetraazacyclododecane and analogs BRACCO DIAGNOSTICS INC. (US) 1997-10-07 US claimed
US-11905257-B2 Manufacturing process for preparing gadoteridol BRACCO IMAGING S.P.A. (IT) 2024-02-20 US disclosed
US-20230391735-A1 MANUFACTURING PROCESS FOR PREPARING GADOTERIDOL BRACCO IMAGING S.P.A. (IT) 2023-12-07 US disclosed
EP-3442949-B1 CONTRAST AGENTS BRACCO IMAGING SPA (IT) 2022-06-08 EP disclosed
US-11324827-B2 Multifunctionalized polyethylene glycol derivative and preparation method therefor XIAMEN SINOPEG BIOTECH CO., LTD. (CN) 2022-05-10 US disclosed
US-11324827-B2 Multifunctionalized polyethylene glycol derivative and preparation method therefor XIAMEN SINOPEG BIOTECH CO., LTD. (CN) 2022-05-10 US disclosed
US-11007283-B2 Contrast agents BRACCO IMAGING S.P.A. (IT) 2021-05-18 US disclosed
CN-108084105-B Gadoteridol intermediate, synthetic method thereof and method for preparing gadoteridol by using gadoteridol intermediate 四川科伦药物研究院有限公司 2020-07-24 CN disclosed
US-20190167819-A1 CONTRAST AGENTS BRACCO IMAGING S.P.A. (IT) 2019-06-06 US disclosed
US-5573752-A Aromatic amide compounds and metal chelates thereof BRACCO INTERNATIONAL B.V. 1996-11-12 US disclosed
EP-0292689-B1 Substituted 1,4,7-triscarboxymethyl-1,4,7,10-tetraazacyclo-dodecane and analogs BRACCO INT BV (NL) 1996-07-31 EP disclosed
EP-0700392-A1 USE OF MACROCYCLIC METAL COMPLEXES AS TEMPERATURE PROBES SCHERING AKTIENGESELLSCHAFT (DE) 1996-03-13 EP disclosed
US-5474756-A Chelate compound of a paramagnetic ion of lanthanide element BRACCO INTERNATIONAL B.V. (NL) 1995-12-12 US disclosed
WO-1995027705-A1 AROMATIC AMIDE COMPOUNDS AND METAL CHELATES THEREOF BRACCO INTERNATIONAL B.V. (NL) 1995-10-19 WO disclosed
WO-1994027977-A1 USE OF MACROCYCLIC METAL COMPLEXES AS TEMPERATURE PROBES SCHERING AKTIENGESELLSCHAFT (DE) 1994-12-08 WO disclosed
EP-0543482-A1 Aminocarboxylate ligands having substituted aromatic amide moieties BRACCO INTERNATIONAL B.V. (NL) 1993-05-26 EP disclosed
US-4885363-A RADIOPHARMACEUTICAL IMAGING; MEDICAL DIAGNOSIS E. R. SQUIBB & SONS, INC. (US) 1989-12-05 US disclosed
EP-0292689-A2 Substituted 1,4,7-triscarboxymethyl-1,4,7,10-tetraazacyclo-dodecane and analogs BRACCO INTERNATIONAL B.V. (NL) 1988-11-30 EP 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 (5 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-11007283-B2 Contrast agents PHOSPHO1, ITPA, PPIP5K2 HIF1A 952/4885MAPT 3772/4885PDE4A 1606/4885
US-20230391735-A1 MANUFACTURING PROCESS FOR PREPARING GADOTERIDOL SSTR2, GCG, ADCYAP1R1 HIF1A 813/4885MAPT 4006/4885PDE4A 721/4885
US-20190167819-A1 CONTRAST AGENTS PHOSPHO1, ITPA, PPIP5K2 HIF1A 952/4885MAPT 3772/4885PDE4A 1606/4885
US-11905257-B2 Manufacturing process for preparing gadoteridol SSTR2, GCG, ADCYAP1R1 HIF1A 813/4885MAPT 4006/4885PDE4A 721/4885
US-11324827-B2 Multifunctionalized polyethylene glycol derivative and preparation method therefor HDGF, F11, F12 HIF1A 1255/4885MAPT 4184/4885PDE4A 4798/4885

“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.