SCHEMBL28739928

SCHEMBL28739928

C=CC(=O)OC(C)[n+]1ccccc1

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.37
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
HTT P42858 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HCAR2 Q8TDS4 2/20 0.31
THRB P10828 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
SCHEMBL4881097 0.78 ALDH1A1 (0.31) TSHRALDH1A1THRB
SCHEMBL10784479 0.74 TSHR (0.37) TSHRALDH1A1LMNAHTTSMN1; SMN2
SCHEMBL23533662 0.71 THRB (0.39) TSHRALDH1A1THRB
Bromide SCHEMBL23121508 0.70 THRB (0.39) TSHRALDH1A1LMNAHTTSMN1; SMN2
Bromide SCHEMBL23853727 0.70 THRB (0.39) TSHRALDH1A1LMNAHTTSMN1; SMN2
Benzene SCHEMBL433355 0.69 TSHR (0.39) TSHRALDH1A1SMN1; SMN2HCAR2THRB
Hydrogen Peroxide SCHEMBL28304770 0.69 TSHR (0.46) TSHRALDH1A1LMNASMN1; SMN2HCAR2
Hydrochloric Acid SCHEMBL9634623 0.68
SCHEMBL31332333 0.68 HCAR2 (0.52) TSHRALDH1A1LMNASMN1; SMN2HCAR2
SCHEMBL2727797 0.68 TSHR (0.50) TSHRALDH1A1LMNASMN1; SMN2HCAR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022182713-A1 METHODS OF PHOTOGRAFTING TO SURFACE METAL OXIDES Orthobond Corporation (US) 2022-09-01 WO claimed
US-20220266296-A1 Methods of Photografting to Surface Metal Oxides Orthobond Corporation 2022-08-25 US claimed
US-20230055449-A1 FUNCTIONAL SURFACES ORTHOBOND CORP (US) 2023-02-23 US disclosed
WO-2022182713-A1 METHODS OF PHOTOGRAFTING TO SURFACE METAL OXIDES Orthobond Corporation (US) 2022-09-01 WO disclosed
US-20220266296-A1 Methods of Photografting to Surface Metal Oxides Orthobond Corporation 2022-08-25 US disclosed
EP-3525776-B1 SURFACES WITH OLIGOMERIC OR POLYMERIC ANTIMICROBIALS ORTHOBOND CORP (US) 2022-01-26 EP disclosed
CN-110312507-B Surfaces with oligomeric or polymeric antimicrobial agents 奥索邦德公司 2021-11-23 CN 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-20230055449-A1 FUNCTIONAL SURFACES LPO, SELP, SIGLEC7 TSHR 2514/4885ALDH1A1 3494/4885LMNA 3860/4885

“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.