SCHEMBL4787698

SCHEMBL4787698

C=CC[PH](=O)OC(=O)C(=C)C

nearest known ligand 0.39

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.39
TSHR P16473 3/20 0.36
THRB P10828 1/20 0.34

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
SCHEMBL21111164 0.76 THRB (0.49) ALDH1A1TSHRTHRB
SCHEMBL3199645 0.75 ALDH1A1 (0.35) ALDH1A1TSHRTHRB
SCHEMBL3691682 0.72 ALDH1A1 (0.50) ALDH1A1TSHRTHRB
SCHEMBL3464476 0.72
SCHEMBL14374070 0.70
Butane SCHEMBL3095446 0.70 TSHR (0.44) ALDH1A1TSHRTHRB
Phosphonic Acid SCHEMBL15392699 0.69 TSHR (0.44) ALDH1A1TSHRTHRB
SCHEMBL28718766 0.68 ALDH1A1 (0.41) ALDH1A1TSHRTHRB
SCHEMBL1057516 0.67 TSHR (0.50) ALDH1A1TSHRTHRB
SCHEMBL22017 0.67

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008121375-A2 MODIFIED SURFACES FOR IMMOBILIZATION OF ACTIVE MOLECULES PACIFIC BIOSCIENCES OF CALIFORNIA, INC. (US) 2008-10-09 WO claimed
US-20080241892-A1 Modified surfaces for immobilization of active molecules PACIFIC BIOSCIENCES OF CALIFORNIA, INC. (US) 2008-10-02 US claimed
WO-2008121375-A2 MODIFIED SURFACES FOR IMMOBILIZATION OF ACTIVE MOLECULES PACIFIC BIOSCIENCES OF CALIFORNIA, INC. (US) 2008-10-09 WO disclosed
US-20080241892-A1 Modified surfaces for immobilization of active molecules PACIFIC BIOSCIENCES OF CALIFORNIA, INC. (US) 2008-10-02 US 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-20080241892-A1 Modified surfaces for immobilization of active molecules EPCAM, SELE, ITGAM ALDH1A1 1408/4885TSHR 1329/4885THRB 2309/4885

“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.