SCHEMBL19611753

SCHEMBL19611753

C=C(C)C(=O)OCC1COC1C(Cl)(Cl)Cl

nearest known ligand 0.57

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.57
TSHR P16473 4/20 0.35
THRB P10828 1/20 0.33
CYP3A4 P08684 1/20 0.30
CYP2D6 P10635 1/20 0.30
CYP2C19 P33261 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
SCHEMBL244960 0.85 ALDH1A1 (0.57) ALDH1A1TSHRTHRBCYP3A4CYP2D6
SCHEMBL243689 0.82 ALDH1A1 (0.54) ALDH1A1TSHRTHRB
SCHEMBL243580 0.78 ALDH1A1 (0.64) ALDH1A1TSHRTHRBCYP3A4CYP2D6
SCHEMBL27642443 0.76 ALDH1A1 (0.62) ALDH1A1TSHRTHRBCYP3A4CYP2D6
SCHEMBL2568740 0.75 ALDH1A1 (0.60) ALDH1A1TSHRTHRBCYP3A4CYP2D6
SCHEMBL29057380 0.74 ALDH1A1 (0.54) ALDH1A1TSHRTHRB
SCHEMBL5098171 0.73 ALDH1A1 (1.00) ALDH1A1TSHRTHRBCYP3A4CYP2D6
SCHEMBL15617 0.73 ALDH1A1 (1.00) ALDH1A1TSHRTHRBCYP3A4CYP2D6
SCHEMBL5098181 0.73 ALDH1A1 (1.00) ALDH1A1TSHRTHRBCYP3A4CYP2D6
SCHEMBL2048901 0.73 ALDH1A1 (1.00) ALDH1A1TSHRTHRBCYP3A4CYP2D6

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
EP-3260477-B1 COMPOSITION FOR POLYMERIZATION, METHOD FOR PRODUCING SAME, COATING COMPOSITION CONTAINING SAME, METHOD FOR PRODUCING COATING COMPOSITION CONTAINING SAID COMPOSITIONS, AND METHOD FOR PRODUCING COATING FUJIFILM CORP (JP) 2022-08-24 EP disclosed
US-10428168-B2 Composition for polymerization, method for producing same, composition for a coating containing composition for polymerization, method for producing composition for a coating using composition for polymerization, and method for producing coating FUJIFILM CORPORATION (JP) 2019-10-01 US disclosed
EP-3260477-A1 COMPOSITION FOR POLYMERIZATION, METHOD FOR PRODUCING SAME, COATING COMPOSITION CONTAINING SAME, METHOD FOR PRODUCING COATING COMPOSITION CONTAINING SAID COMPOSITIONS, AND METHOD FOR PRODUCING COATING FUJIFILM Corporation (JP) 2017-12-27 EP disclosed
US-20170335041-A1 COMPOSITION FOR POLYMERIZATION, METHOD FOR PRODUCING SAME, COMPOSITION FOR A COATING CONTAINING COMPOSITION FOR POLYMERIZATION, METHOD FOR PRODUCING COMPOSITION FOR A COATING USING COMPOSITION FOR POLYMERIZATION, AND METHOD FOR PRODUCING COATING FUJIFILM CORPORATION (JP) 2017-11-23 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 (2 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-20170335041-A1 COMPOSITION FOR POLYMERIZATION, METHOD FOR PRODUCING SAME, COMPOSITION FOR A COATING CONTAINING COMPOSITION FOR POLYMERIZATION, METHOD FOR PRODUCING COMPOSITION FOR A COATING USING COMPOSITION FOR POLYMERIZATION, AND METHOD FOR PRODUCING COATING BHMT2, SETDB1, MAT2B ALDH1A1 2118/4885TSHR 4534/4885THRB 3076/4885
US-10428168-B2 Composition for polymerization, method for producing same, composition for a coating containing composition for polymerization, method for producing composition for a coating using composition for polymerization, and method for producing coating MMAB, SRM, AHCY ALDH1A1 1951/4885TSHR 4722/4885THRB 3453/4885

“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.