SCHEMBL9520543

SCHEMBL9520543

O=C1CCc2cc(O)c(I)cc21

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PBRM1 Q86U86 1/20 0.50
HSD17B1 P14061 5/20 0.44
CASP1 P29466 1/20 0.41
CASP7 P55210 1/20 0.41
HSD17B10 Q99714 1/20 0.41
MAOB P27338 2/20 0.39
MAOA P21397 1/20 0.39
PRKCI P41743 1/20 0.39
EGFR P00533 1/20 0.38
MEN1 O00255 1/20 0.35
MAPK1 P28482 1/20 0.35
KMT2A Q03164 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
GRM5 P41594 1/20 0.35
CYP1A2 P05177 1/20 0.33
CYP11B1 P15538 1/20 0.33
CYP11B2 P19099 1/20 0.33
BRD4 O60885 1/20 0.30
ADCY6 O43306 1/20 0.30
ADCY3 O60266 1/20 0.30

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
SCHEMBL2930139 0.92 PBRM1 (0.50) PBRM1HSD17B1CASP1CASP7HSD17B10
SCHEMBL9827282 0.88 MAOB (0.58) PBRM1HSD17B1CASP1CASP7HSD17B10
SCHEMBL2932814 0.83 PBRM1 (0.57) PBRM1HSD17B1CASP1CASP7HSD17B10
SCHEMBL11980463 0.76 PBRM1 (0.41) PBRM1HSD17B1CASP1CASP7HSD17B10
SCHEMBL1032102 0.76 PBRM1 (0.50) PBRM1HSD17B1CASP1CASP7HSD17B10
SCHEMBL25269929 0.76 HSD17B1 (0.60) PBRM1HSD17B1CASP1CASP7HSD17B10
SCHEMBL7894570 0.76 HSD17B1 (0.44) PBRM1HSD17B1CASP1CASP7HSD17B10
SCHEMBL26650523 0.76 PBRM1 (0.50) PBRM1HSD17B1CASP1CASP7HSD17B10
SCHEMBL2304058 0.76 PBRM1 (0.50) PBRM1HSD17B1CASP1CASP7HSD17B10
SCHEMBL11980466 0.76 CASP1 (0.50) PBRM1HSD17B1CASP1CASP7HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12545653-B2 Compound as PPAR agonist and application thereof USA Elixiria Biotech Inc. (US) 2026-02-10 US disclosed
US-20230322692-A1 COMPOUND AS PPAR AGONIST AND APPLICATION THEREOF USA Elixiria Biotech Inc. (US) 2023-10-12 US disclosed
US-20230322692-A1 COMPOUND AS PPAR AGONIST AND APPLICATION THEREOF USA Elixiria Biotech Inc. (US) 2023-10-12 US disclosed
US-11691953-B2 Compound as PPAR agonist and application thereof USA Elixiria Biotech Inc. 2023-07-04 US disclosed
US-11691953-B2 Compound as PPAR agonist and application thereof USA Elixiria Biotech Inc. 2023-07-04 US disclosed
US-11691953-B2 Compound as PPAR agonist and application thereof USA Elixiria Biotech Inc. 2023-07-04 US disclosed
US-20200331868-A1 COMPOUND AS PPAR AGONIST AND APPLICATION THEREOF USA Elixiria Biotech Inc. 2020-10-22 US disclosed
US-20200331868-A1 COMPOUND AS PPAR AGONIST AND APPLICATION THEREOF USA Elixiria Biotech Inc. 2020-10-22 US disclosed
EP-0325963-B1 1-AMINOMETHYL-1,2,3,4-TETRAHYDRONAPHTHALENES AND -INDANES ABBOTT LABORATORIES (US) 1993-09-22 EP disclosed
US-5140040-A Alpha-2-adrenergic receptor antagonist; glaucoma; congestive heart failure; hypotensive agents; headaches; metabolic disorders (diabetes, obesity) ABBOTT LABORATORIES (US) 1992-08-18 US disclosed
US-5128362-A Antidepressant, antiglaucoma ABBOTT LABORATORIES (US) 1992-07-07 US disclosed
US-5086074-A Selective adrenergic receptor antagonists ABBOTT LABORATORIES (US) 1992-02-04 US disclosed
EP-0325963-A1 1-Aminomethyl-1,2,3,4-tetrahydronaphthalenes and -indanes ABBOTT LABORATORIES (US) 1989-08-02 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 (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-12545653-B2 Compound as PPAR agonist and application thereof PPARA, PPARD, PPARG PBRM1 1778/4885HSD17B1 266/4885CASP1 2989/4885
US-11691953-B2 Compound as PPAR agonist and application thereof PPARA, PPARG, PPARD PBRM1 2822/4885HSD17B1 716/4885CASP1 3311/4885
US-20200331868-A1 COMPOUND AS PPAR AGONIST AND APPLICATION THEREOF PPARA, PPARG, PPARD PBRM1 2822/4885HSD17B1 716/4885CASP1 3311/4885
US-20230322692-A1 COMPOUND AS PPAR AGONIST AND APPLICATION THEREOF PPARA, PPARG, PPARD PBRM1 2822/4885HSD17B1 716/4885CASP1 3311/4885

“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.