SCHEMBL5548988

SCHEMBL5548988

O=C(O)CN1CCN(CC(=O)OCc2ccccc2)CCN(CC(=O)OCc2ccccc2)CCN(CC(=O)OCc2ccccc2)CC1

nearest known ligand 0.67

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.55
SMN1; SMN2 Q16637 2/20 0.55
MAPK1 P28482 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
KMT2A Q03164 3/20 0.51
MEN1 O00255 2/20 0.51
POLB P06746 1/20 0.51
CYP1A2 P05177 1/20 0.49
CYP2C9 P11712 1/20 0.49
CYP2C19 P33261 1/20 0.49
NPSR1 Q6W5P4 1/20 0.47
PPARG P37231 1/20 0.46
PPARA Q07869 1/20 0.46
SLC6A2 P23975 1/20 0.46
SLC6A3 Q01959 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
NOTUM Q6P988 1/20 0.46
NPC1 O15118 1/20 0.46
RAB9A P51151 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
SCHEMBL25419509 1.00 ALDH1A1 (0.55) ALDH1A1SMN1; SMN2MAPK1L3MBTL1KMT2A
SCHEMBL15776693 1.00 ALDH1A1 (0.55) ALDH1A1SMN1; SMN2MAPK1L3MBTL1KMT2A
SCHEMBL24251635 0.95 ALDH1A1 (0.59) ALDH1A1SMN1; SMN2MAPK1L3MBTL1KMT2A
SCHEMBL23891826 0.93 ALDH1A1 (0.50) ALDH1A1SMN1; SMN2MAPK1L3MBTL1KMT2A
SCHEMBL14470269 0.93 ALDH1A1 (0.49) ALDH1A1SMN1; SMN2MAPK1L3MBTL1KMT2A
SCHEMBL17921382 0.93 ALDH1A1 (0.49) ALDH1A1SMN1; SMN2MAPK1L3MBTL1KMT2A
SCHEMBL15982310 0.92 ALDH1A1 (0.54) ALDH1A1SMN1; SMN2MAPK1L3MBTL1KMT2A
SCHEMBL26331756 0.92 ALDH1A1 (0.48) ALDH1A1SMN1; SMN2MAPK1L3MBTL1KMT2A
SCHEMBL23891709 0.90 ALDH1A1 (0.47) ALDH1A1SMN1; SMN2MAPK1L3MBTL1KMT2A
SCHEMBL3569051 0.89 ALDH1A1 (0.68) ALDH1A1SMN1; SMN2MAPK1L3MBTL1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250009915-A1 NOVEL NITROGEN-CONTAINING COMPOUND OR SALT THEREOF, OR METAL COMPLEX THEREOF FUJIFILM CORPORATION (JP) 2025-01-09 US disclosed
US-20240066156-A1 Targeted Radiotherapy Chelates for In Situ Immune Modulated Cancer Vaccination WISCONSIN ALUMNI RESEARCH FOUNDATION 2024-02-29 US disclosed
US-20230398239-A1 Using Targeted Radiotherapy (TRT) to Drive Anti-Tumor Immune Response to Immunotherapies WISCONSIN ALUMNI RESEARCH FOUNDATION 2023-12-14 US disclosed
US-20230310610-A1 Long-Lived Gadolinium Based Tumor Targeted Imaging and Therapy Agents WISCONSIN ALUMNI RESEARCH FOUNDATION 2023-10-05 US disclosed
EP-4249471-A2 PHARMACEUTICAL COMPOSITION OF A NITROGEN-CONTAINING COMPOUND OR SALT THEREOF, OR METAL COMPLEX THEREOF FUJIFILM Corporation (JP) 2023-09-27 EP disclosed
EP-3929196-B1 PHARMACEUTICAL COMPOSITION OF A NITROGEN-CONTAINING COMPOUND OR SALT THEREOF, OR METAL COMPLEX THEREOF FUJIFILM CORP (JP) 2023-08-23 EP disclosed
EP-3929196-B1 PHARMACEUTICAL COMPOSITION OF A NITROGEN-CONTAINING COMPOUND OR SALT THEREOF, OR METAL COMPLEX THEREOF FUJIFILM CORP (JP) 2023-08-23 EP disclosed
US-11730834-B2 Targeted radiotherapy chelates for in situ immune modulated cancer vaccination WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2023-08-22 US disclosed
US-20230136073-A1 NOVEL NITROGEN-CONTAINING COMPOUND OR SALT THEREOF, OR METAL COMPLEX THEREOF FUJIFILM CORPORATION (JP) 2023-05-04 US disclosed
US-20230136073-A1 NOVEL NITROGEN-CONTAINING COMPOUND OR SALT THEREOF, OR METAL COMPLEX THEREOF FUJIFILM CORPORATION (JP) 2023-05-04 US disclosed
US-9446157-B2 Chelated PSMA inhibitors CANCER TARGETED TECHNOLOGY LLC (US) 2016-09-20 US disclosed
US-9446157-B2 Chelated PSMA inhibitors CANCER TARGETED TECHNOLOGY LLC (US) 2016-09-20 US disclosed
US-20160199520-A1 NOVEL NITROGEN-CONTAINING COMPOUND OR SALT THEREOF, OR METAL COMPLEX THEREOF FUJIFILM CORPORATION (JP) 2016-07-14 US disclosed
US-20140241985-A1 Chelated PSMA Inhibitors CANCER TARGETED TECHNOLOGY LLC (US) 2014-08-28 US disclosed
US-20140241985-A1 Chelated PSMA Inhibitors CANCER TARGETED TECHNOLOGY LLC (US) 2014-08-28 US disclosed
EP-1806350-A2 Amphipatic polycarboxylic chelates and complexes with paramagnetic metals as MRI contrast agents BRACCO International B.V. (NL) 2007-07-11 EP disclosed
EP-1153029-B1 AMPHIPATIC POLYCARBOXYLIC CHELATES AND COMPLEXES WITH PARAMAGNETIC METALS AS MRI CONTRAST AGENTS BRACCO INT BV (NL) 2007-01-10 EP disclosed
US-6652834-B2 Tensioactive properties, long lasting activity in the blood pool BRACCO INTERNATIONAL B.V. (NL) 2003-11-25 US disclosed
US-20020098152-A1 Amphipatic polycarboxylic chelates and complexes with paramagnetic metals as MRI contrast agents BRACCO INTERNATIONAL B.V. 2002-07-25 US disclosed
US-6342598-B1 BLOOD-POOL CONTRAST AGENTS OF OUTSTANDING LONG LIFE IN CIRCULATION BRACCO INTERNATIONAL B.V. (NL) 2002-01-29 US 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 (9 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-20230136073-A1 NOVEL NITROGEN-CONTAINING COMPOUND OR SALT THEREOF, OR METAL COMPLEX THEREOF SLC39A3, SLC39A14, SLC39A11 ALDH1A1 3098/4885SMN1; SMN2 2614/4885MAPK1 384/4885
US-20020098152-A1 Amphipatic polycarboxylic chelates and complexes with paramagnetic metals as MRI contrast agents SLC39A14, HAMP, PICALM ALDH1A1 4599/4885SMN1; SMN2 2228/4885MAPK1 3435/4885
US-11730834-B2 Targeted radiotherapy chelates for in situ immune modulated cancer vaccination CD47, STING1, ARG1 ALDH1A1 2324/4885SMN1; SMN2 1398/4885MAPK1 2295/4885
US-20230398239-A1 Using Targeted Radiotherapy (TRT) to Drive Anti-Tumor Immune Response to Immunotherapies CD274, CD47, PDCD1 ALDH1A1 3521/4885SMN1; SMN2 1561/4885MAPK1 985/4885
US-20240066156-A1 Targeted Radiotherapy Chelates for In Situ Immune Modulated Cancer Vaccination CD47, STING1, ARG1 ALDH1A1 2324/4885SMN1; SMN2 1398/4885MAPK1 2295/4885
US-20160199520-A1 NOVEL NITROGEN-CONTAINING COMPOUND OR SALT THEREOF, OR METAL COMPLEX THEREOF SLC39A3, SLC39A14, SLC39A11 ALDH1A1 3116/4885SMN1; SMN2 2615/4885MAPK1 393/4885
US-20230310610-A1 Long-Lived Gadolinium Based Tumor Targeted Imaging and Therapy Agents H1-2, H1-3, H1-0 ALDH1A1 3582/4885SMN1; SMN2 2598/4885MAPK1 1930/4885
US-20140241985-A1 Chelated PSMA Inhibitors FOLH1, KLK3, PSMA1 ALDH1A1 1059/4885SMN1; SMN2 3881/4885MAPK1 3334/4885
US-20250009915-A1 NOVEL NITROGEN-CONTAINING COMPOUND OR SALT THEREOF, OR METAL COMPLEX THEREOF SLC39A3, SLC39A14, SLC39A11 ALDH1A1 3116/4885SMN1; SMN2 2615/4885MAPK1 393/4885

“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.