SCHEMBL21670433

SCHEMBL21670433

C=C[C](C)CCC[C](C)C

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.33
TSHR P16473 2/20 0.33
TP53 P04637 1/20 0.33

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
SCHEMBL202195 0.78
SCHEMBL4228159 0.76
SCHEMBL4228053 0.76 TSHR (0.50) ALDH1A1TSHRTP53
SCHEMBL2933239 0.74
SCHEMBL8909686 0.74 GPR84 (0.39) ALDH1A1TSHRTP53
SCHEMBL19951334 0.72 PTPN1 (0.42) TSHR
SCHEMBL9343994 0.71
SCHEMBL10493669 0.71
SCHEMBL1165544 0.69
SCHEMBL9173888 0.69

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11578175-B2 Preparation method of super absorbent polymer LG CHEM, LTD. 2023-02-14 US disclosed
US-11560463-B2 Cross-linking agent compound and polymer prepared using the same LG CHEM, LTD. 2023-01-24 US disclosed
CN-111433267-B Novel crosslinker compounds and polymers prepared using the same 株式会社LG化学 2021-10-26 CN disclosed
EP-3702402-B1 NOVEL CROSS-LINKING AGENT COMPOUND AND POLYMER PREPARED USING SAME LG CHEMICAL LTD (KR) 2021-10-20 EP disclosed
US-20210115222-A1 Novel Cross-Linking Agent Compound and Polymer Prepared Using the Same LG CHEM, LTD. (KR) 2021-04-22 US disclosed
EP-3608359-B1 METHOD FOR PREPARING SUPERABSORBENT POLYMER LG CHEMICAL LTD (KR) 2021-04-07 EP disclosed
CN-110506074-B Method for preparing super absorbent polymer 株式会社LG化学 2021-03-26 CN disclosed
EP-3702402-A1 NOVEL CROSS-LINKING AGENT COMPOUND AND POLYMER PREPARED USING SAME LG Chem, Ltd. (KR) 2020-09-02 EP disclosed
CN-111433267-A Novel crosslinker compounds and polymers prepared using the same 株式会社LG化学 2020-07-17 CN disclosed
US-20200115508-A1 Preparation Method of Super Absorbent Polymer LG CHEM, LTD. (KR) 2020-04-16 US disclosed
EP-3608359-A1 METHOD FOR PREPARING SUPERABSORBENT POLYMER LG Chem, Ltd. (KR) 2020-02-12 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 (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-11560463-B2 Cross-linking agent compound and polymer prepared using the same PCNA, JMJD7, DCLRE1A ALDH1A1 1533/4885TSHR 4874/4885TP53 734/4885

“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.