SCHEMBL29500300

SCHEMBL29500300

COCCN1CCc2ccccc2C1=O

nearest known ligand 0.55

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ DRD3 P35462 13/20 0.55
▸ DRD2 P14416 5/20 0.55
▸ DRD4 P21917 1/20 0.55
▸ DRD1 P21728 6/20 0.54
▸ AOC3 Q16853 2/20 0.51
▸ ACHE P22303 1/20 0.50
▸ NPC1 O15118 1/20 0.48
▸ ALDH1A1 P00352 1/20 0.48
▸ RAB9A P51151 1/20 0.48

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
SCHEMBL25225949 0.84 KDM4E (0.59) DRD3DRD2ALDH1A1
SCHEMBL15690244 0.80 AOC3 (0.56) DRD3DRD2DRD4DRD1AOC3
SCHEMBL22725992 0.80 AOC3 (0.58) DRD3DRD2DRD4AOC3
SCHEMBL15691861 0.80 BCAT2 (0.47) DRD3DRD2DRD4DRD1ACHE
SCHEMBL5811132 0.80 GRM5 (0.64) DRD3DRD2DRD4DRD1ACHE
SCHEMBL31134854 0.80 GRM5 (0.64) DRD3DRD2DRD4DRD1ACHE
SCHEMBL7683501 0.80 DRD3 (0.56) DRD3DRD2DRD4DRD1ACHE
SCHEMBL7686132 0.80 DRD3 (0.53) DRD3DRD2DRD4DRD1ACHE
SCHEMBL30183479 0.80 DRD3 (0.53) DRD3DRD2DRD4DRD1ACHE
SCHEMBL179076 0.79 HTT (0.51) DRD3DRD2DRD4DRD1ACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240025875-A1 A COMPOUND AS A THYROID HORMONE BETA RECEPTOR AGONIST AND USE THEREOF SUNSHINE LAKE PHARMA CO., LTD. (CN) 2024-01-25 — — US disclosed
WO-2022057845-A1 COMPOUND SERVING AS THYROID HORMONE β RECEPTOR AGONIST AND USES OF COMPOUND 广东东阳光药业有限公司 2022-03-24 — — 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-20240025875-A1 A COMPOUND AS A THYROID HORMONE BETA RECEPTOR AGONIST AND USE THEREOF THRB, TSHR, THRA DRD3 1151/4885DRD2 955/4885DRD4 1180/4885

“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.

Send feedback