SCHEMBL7938008

SCHEMBL7938008

CC1(C)C(C(=O)O)C(C(=O)O)C(C)(C)N1O

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
APLNR P35414 1/20 0.35
GAA P10253 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
ALDH1A1 P00352 2/20 0.31
TP53 P04637 1/20 0.31
ALOX15 P16050 1/20 0.31
MAPK1 P28482 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
HSD17B10 Q99714 1/20 0.31
TSHR P16473 1/20 0.31
TDP1 Q9NUW8 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
SCHEMBL9272403 1.00 APLNR (0.35) APLNRGAAL3MBTL1ALDH1A1TP53
SCHEMBL8601934 0.84 ALDH1A1 (0.30) ALDH1A1TP53ALOX15MAPK1SMN1; SMN2
SCHEMBL12500631 0.80 KMT2A (0.30)
SCHEMBL7939011 0.78 APLNR (0.35) APLNRALDH1A1TP53ALOX15MAPK1
SCHEMBL7938007 0.78 APLNR (0.35) APLNRALDH1A1TP53ALOX15MAPK1
SCHEMBL7938005 0.78 APLNR (0.35) APLNRALDH1A1TP53ALOX15MAPK1
SCHEMBL8598869 0.76 GAA (0.31) GAAL3MBTL1
SCHEMBL11260869 0.69 APLNR (0.41) APLNRALDH1A1TP53ALOX15MAPK1
SCHEMBL3385056 0.69 APLNR (0.41) APLNRALDH1A1TP53ALOX15MAPK1
SCHEMBL5246594 0.69 APLNR (0.41) APLNRALDH1A1TP53ALOX15MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4627345-A1 MEASUREMENT OF REACTIVE OXYGEN SPECIES TO ASSESS RED BLOOD CELL QUALITY University Of Maryland, Baltimore (US) 2025-10-08 EP claimed
US-20250298040-A1 MEASUREMENT OF REACTIVE OXYGEN SPECIES TO ASSESS RED BLOOD CELL QUALITY UNIVERSITY OF MARYLAND, BALTIMORE 2025-09-25 US claimed
WO-2024119059-A1 MEASUREMENT OF REACTIVE OXYGEN SPECIES TO ASSESS RED BLOOD CELL QUALITY UNIVERSITY OF MARYLAND, BALTIMORE (US) 2024-06-06 WO claimed
EP-4627345-A1 MEASUREMENT OF REACTIVE OXYGEN SPECIES TO ASSESS RED BLOOD CELL QUALITY University Of Maryland, Baltimore (US) 2025-10-08 EP disclosed
US-20250298040-A1 MEASUREMENT OF REACTIVE OXYGEN SPECIES TO ASSESS RED BLOOD CELL QUALITY UNIVERSITY OF MARYLAND, BALTIMORE 2025-09-25 US disclosed
WO-2024119059-A1 MEASUREMENT OF REACTIVE OXYGEN SPECIES TO ASSESS RED BLOOD CELL QUALITY UNIVERSITY OF MARYLAND, BALTIMORE (US) 2024-06-06 WO disclosed
US-6239145-B1 USABLE IN ACQUIRING INFORMATION ABOUT ACTIVE OXYGEN OR IN VIVO FREE RADICALS AS BIOLOGICAL IMAGES SUCH AS MAGNETIC RESONANCE IMAGES OR MAGNETOENCEPHALOGRAMS; DAIITCHI RADIOISOTOPE LABORATORIES, LTD. (JP) 2001-05-29 US disclosed
EP-0995740-A1 NOVEL NITROXYL COMPOUNDS AND DRUGS AND REAGENTS CONTAINING THE SAME AS THE ACTIVE INGREDIENT DAIICHI RADIOISOTOPE LABORATORIES, LTD. (JP) 2000-04-26 EP disclosed
US-5407657-A Containing a metal chelate and a free radical nitroxide IMARX THERAPEUTICS, INC. 1995-04-18 US disclosed