SCHEMBL5313637

SCHEMBL5313637

CCOC(=O)c1c[nH]c2ccc(F)cc12

nearest known ligand 0.61

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.61
GABRA1 P14867 3/20 0.60
GABRB2 P47870 3/20 0.60
GABRB1 P18505 2/20 0.59
GABRA3 P34903 2/20 0.59
MEN1 O00255 1/20 0.54
TP53 P04637 1/20 0.54
HPGD P15428 1/20 0.54
KMT2A Q03164 1/20 0.54
HSD17B10 Q99714 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
NR4A2 P43354 3/20 0.54
KDM4E B2RXH2 1/20 0.54
TSHR P16473 2/20 0.52

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
SCHEMBL30175047 1.00 ALDH1A1 (0.61) ALDH1A1GABRA1GABRB2GABRB1GABRA3
SCHEMBL846416 0.91 GABRA1 (0.74) ALDH1A1GABRA1GABRB2GABRB1GABRA3
SCHEMBL27967224 0.89 NR4A2 (0.57) ALDH1A1GABRA1GABRB2GABRB1GABRA3
SCHEMBL29800593 0.89 NR4A2 (0.54) ALDH1A1GABRA1GABRB2GABRB1GABRA3
SCHEMBL22864631 0.89 NR4A2 (0.54) ALDH1A1GABRA1GABRB2GABRB1GABRA3
SCHEMBL1994694 0.86 ALDH1A1 (0.58) ALDH1A1GABRA1GABRB2GABRB1GABRA3
SCHEMBL830179 0.85 NR4A2 (0.73) ALDH1A1GABRA1GABRB2GABRB1GABRA3
SCHEMBL2050904 0.84 GABRA1 (0.61) ALDH1A1GABRA1GABRB2GABRB1GABRA3
SCHEMBL995637 0.84 NR4A2 (0.70) ALDH1A1HPGDKMT2ANR4A2KDM4E
SCHEMBL3177863 0.83 ALDH1A1 (0.48) ALDH1A1GABRA1GABRB2GABRB1GABRA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230146829-A1 SELECTIVE ANDROGEN RECEPTOR DEGRADER (SARD) LIGANDS AND METHODS OF USE THEREOF UNIV TENNESSEE RES FOUND (US) 2023-05-11 US disclosed
US-20230146829-A1 SELECTIVE ANDROGEN RECEPTOR DEGRADER (SARD) LIGANDS AND METHODS OF USE THEREOF UNIV TENNESSEE RES FOUND (US) 2023-05-11 US disclosed
US-20230146829-A1 SELECTIVE ANDROGEN RECEPTOR DEGRADER (SARD) LIGANDS AND METHODS OF USE THEREOF UNIV TENNESSEE RES FOUND (US) 2023-05-11 US disclosed
EP-4110327-A1 SELECTIVE ANDROGEN RECEPTOR DEGRADER (SARD) LIGANDS AND METHODS OF USE THEREOF University of Tennessee Research Foundation (US) 2023-01-04 EP disclosed
CN-115484947-A Selective Androgen Receptor Degrader (SARD) ligands and methods of use thereof 田纳西大学研究基金会 2022-12-16 CN disclosed
WO-2007058504-A1 NOVEL COMPOUNDS AS AGONIST FOR PPAR GAMMA AND PPAR ALPHA, METHOD FOR PREPARATION OF THE SAME, AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME LG LIFE SCIENCES, LTD. (KR) 2007-05-24 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 (1 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-20230146829-A1 SELECTIVE ANDROGEN RECEPTOR DEGRADER (SARD) LIGANDS AND METHODS OF USE THEREOF AR, BRCA1, FSHR ALDH1A1 1972/4885GABRA1 1279/4885GABRB2 1483/4885

“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.