SCHEMBL21888880

SCHEMBL21888880

C=C(C)C(=O)OCCCOc1ccc(-c2cccc(C(=O)c3cccc(-c4ccc(OCCCOC(=O)C(=C)C)cc4)c3)c2)cc1

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 2/20 0.56
▸ POLB P06746 1/20 0.56
▸ APEX1 P27695 1/20 0.56
▸ HTT P42858 1/20 0.56
▸ FFAR4 Q5NUL3 4/20 0.46
▸ GAA P10253 2/20 0.44
▸ LMNA P02545 2/20 0.44
▸ ELANE P08246 1/20 0.43
▸ FFAR1 O14842 2/20 0.43
▸ NPC1 O15118 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ PPARG P37231 2/20 0.42
▸ PPARD Q03181 2/20 0.42
▸ PPARA Q07869 2/20 0.42
▸ MAPK1 P28482 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ MAPT P10636 1/20 0.41

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
SCHEMBL21888886 0.91 POLB (0.51) TDP1POLBAPEX1HTTLMNA
SCHEMBL21889797 0.87 HTT (0.68) TDP1POLBAPEX1HTTGAA
SCHEMBL2604667 0.86 POLB (0.60) TDP1POLBAPEX1HTTFFAR4
SCHEMBL29315994 0.86 POLB (0.66) TDP1POLBAPEX1HTTFFAR4
SCHEMBL19730207 0.84 POLB (0.53) TDP1POLBAPEX1HTTFFAR4
SCHEMBL29316000 0.83 POLB (0.70) TDP1POLBAPEX1HTTPPARG
SCHEMBL14400544 0.83 HTT (0.73) TDP1POLBAPEX1HTTGAA
SCHEMBL21889396 0.82 HTT (0.62) TDP1POLBAPEX1HTTGAA
SCHEMBL29316005 0.82 POLB (0.72) TDP1POLBAPEX1HTT
SCHEMBL29316003 0.82 POLB (0.72) TDP1POLBAPEX1HTT

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-10954183-B2 Curable composition, semi-cured product, cured product, optical member, lens, and compound FUJIFILM CORPORATION (JP) 2021-03-23 — — US disclosed
US-20200115316-A1 CURABLE COMPOSITION, SEMI-CURED PRODUCT, CURED PRODUCT, OPTICAL MEMBER, LENS, AND COMPOUND FUJIFILM CORPORATION (JP) 2020-04-16 — — 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-20200115316-A1 CURABLE COMPOSITION, SEMI-CURED PRODUCT, CURED PRODUCT, OPTICAL MEMBER, LENS, AND COMPOUND CRYAA, Q6ZSR9, CRYZ TDP1 4660/4885POLB 3686/4885APEX1 4544/4885
US-10954183-B2 Curable composition, semi-cured product, cured product, optical member, lens, and compound CRYAA, Q6ZSR9, CRYZ TDP1 4660/4885POLB 3686/4885APEX1 4544/4885

“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.

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