SCHEMBL6762577

SCHEMBL6762577

N=C(CCC(=O)OC(=O)c1cccnc1)OC(=O)c1cccnc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.51
KMT2A Q03164 6/20 0.48
LMNA P02545 6/20 0.48
TDP1 Q9NUW8 2/20 0.48
L3MBTL1 Q9Y468 1/20 0.47
GAA P10253 2/20 0.45
APP P05067 1/20 0.45
HCAR3 P49019 1/20 0.45
HCAR2 Q8TDS4 1/20 0.45
KDM4E B2RXH2 1/20 0.45
ATM Q13315 1/20 0.44
MAPK1 P28482 1/20 0.44
MAPT P10636 1/20 0.44
MEN1 O00255 1/20 0.44
USP2 O75604 1/20 0.44
F7 P08709 1/20 0.44
F3 P13726 1/20 0.44
SARM1 Q6SZW1 1/20 0.44
SIRT2 Q8IXJ6 1/20 0.44
SIRT6 Q8N6T7 1/20 0.44

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
Hydrazine SCHEMBL2725095 0.96 ALDH1A1 (0.48) ALDH1A1KMT2ALMNATDP1L3MBTL1
SCHEMBL25346540 0.85 ALDH1A1 (0.54) ALDH1A1KMT2ALMNATDP1L3MBTL1
SCHEMBL17895063 0.84 ALDH1A1 (0.66) ALDH1A1KMT2ALMNATDP1L3MBTL1
SCHEMBL27623813 0.83 ALDH1A1 (0.56) ALDH1A1KMT2ALMNATDP1L3MBTL1
SCHEMBL23069546 0.82 L3MBTL1 (0.60) ALDH1A1KMT2ALMNATDP1L3MBTL1
SCHEMBL4646985 0.82 ALDH1A1 (0.54) ALDH1A1KMT2ALMNATDP1L3MBTL1
SCHEMBL6754862 0.81 MAPK1 (0.46) ALDH1A1KMT2ALMNATDP1L3MBTL1
SCHEMBL9696285 0.81 ALDH1A1 (0.66) ALDH1A1KMT2ALMNATDP1L3MBTL1
SCHEMBL4996696 0.80 ALDH1A1 (0.64) ALDH1A1KMT2ALMNATDP1L3MBTL1
SCHEMBL514512 0.80 ALDH1A1 (0.59) ALDH1A1KMT2ALMNATDP1L3MBTL1

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 18 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107335061-B Cytotoxic benzodiazepine derivatives 伊缪诺金公司 2021-09-07 CN disclosed
US-20040247523-A1 Simultaneous dual isotope imaging of cardiac perfusion and cardiac inflammation BRISTOL-MYERS SQUIBB PHARMA COMPANY 2004-12-09 US disclosed
US-6770259-B2 ADMINISTEING RADIOLABELED LEUKOTRIENE (LTB4) BINDING AGENT AND A RADIOLABELED PERFUSION IMAGING AGENT; CONCURRENTLY DETECTING THE RADIOLABELED LTB4 BINDING AGENT BOUND AT THE LTB4 RECEPTOR AND THE RADIOLABELED PERFUSION IMAGING AGENT BRISTOL-MYERS SQUIBB PHARMA COMPANY 2004-08-03 US disclosed
WO-2003099810-A2 RADIOPHARMACEUTICALS FOR IMAGING INFECTION AND INFLAMMATION BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2003-12-04 WO disclosed
EP-1347784-A2 SIMULTANEOUS DUAL ISOTOPE IMAGING OF CARDIAC PERFUSION AND CARDIAC INFLAMMATION Bristol-Myers Squibb Pharma Company (US) 2003-10-01 EP disclosed
US-20030124053-A1 Radiopharmaceuticals for imaging infection and inflammation BRISTOL-MYERS SQUIBB COMPANY 2003-07-03 US disclosed
EP-0999856-B1 RADIOPHARMACEUTICALS FOR IMAGING INFECTION AND INFLAMMATION BRISTOL MYERS SQUIBB PHARMA CO (US) 2003-05-14 EP disclosed
EP-1293214-A2 LTB4 antagonists and radiopharmaceuticals for imaging infection and inflammation Bristol-Myers Squibb Pharma Company (US) 2003-03-19 EP disclosed
US-20030007927-A1 Radiopharmaceuticals for imaging infection and inflammation BARRETT JOHN A (US) 2003-01-09 US disclosed
US-20030003049-A1 Simultaneous dual isotope imaging of cardiac perfusion and cardiac inflammation LANTHEUS MEDICAL IMAGING, INC. 2003-01-02 US disclosed
US-6416733-B1 RADIOPHARMACEUTICALS BIND IN VIVO TO THE LEUKOTRIENE B4 (LTB4) RECEPTOR ON THE SURFACE OF LEUKOCYTES WHICH ACCUMULATE AT THE SITE OF INFECTION AND INFLAMMATION BRISTOL-MYERS SQUIBB PHARMA COMPANY 2002-07-09 US disclosed
WO-2002036173-A2 SIMULTANEOUS DUAL ISOTOPE IMAGING OF CARDIAC PERFUSION AND CARDIAC INFLAMMATION BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2002-05-10 WO disclosed
EP-0999856-A2 RADIOPHARMACEUTICALS FOR IMAGING INFECTION AND INFLAMMATION Du Pont Pharmaceuticals Company (US) 2000-05-17 EP disclosed
WO-1998015295-A2 RADIOPHARMACEUTICALS FOR IMAGING INFECTION AND INFLAMMATION DUPONT PHARMACEUTICALS COMPANY (US) 1998-04-16 WO disclosed
US-5155227-A Compounds for site-enhanced delivery of radionuclides UNIVERSITY OF FLORIDA (US) 1992-10-13 US disclosed
US-4963688-A Compounds for site-enhanced delivery of radionuclides and uses thereof UNIVERSITY OF FLORIDA (US) 1990-10-16 US disclosed
EP-0187832-A1 COMPOUNDS FOR SITE-ENHANCED DELIVERY OF RADIONUCLIDES AND USES THEREOF UNIVERSITY OF FLORIDA (US) 1986-07-23 EP disclosed
WO-1986000898-A1 COMPOUNDS FOR SITE-ENHANCED DELIVERY OF RADIONUCLIDES AND USES THEREOF UNIVERSITY OF FLORIDA (US) 1986-02-13 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 (4 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-20030124053-A1 Radiopharmaceuticals for imaging infection and inflammation LTB4R, LTB4R2, LTA4H ALDH1A1 2561/4885KMT2A 4348/4885LMNA 2635/4885
US-20030007927-A1 Radiopharmaceuticals for imaging infection and inflammation LTB4R, LTB4R2, LTA4H ALDH1A1 2561/4885KMT2A 4348/4885LMNA 2635/4885
US-20040247523-A1 Simultaneous dual isotope imaging of cardiac perfusion and cardiac inflammation LTB4R, LTB4R2, FABP3 ALDH1A1 2377/4885KMT2A 4810/4885LMNA 3613/4885
US-20030003049-A1 Simultaneous dual isotope imaging of cardiac perfusion and cardiac inflammation LTB4R, LTB4R2, FABP3 ALDH1A1 2377/4885KMT2A 4810/4885LMNA 3613/4885

“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.