SCHEMBL16127811

SCHEMBL16127811

C=C(C)C(=O)OCC(COC(=O)C(=C)CC(C)(C)C(=O)OCC(COC(=O)C(=C)C)OC(=O)Nc1ccccc1-c1ccccc1)OC(=O)Nc1ccccc1-c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 3/20 0.38
▸ HTT P42858 1/20 0.38
▸ CHRM3 P20309 14/20 0.37
▸ CHRM2 P08172 1/20 0.36
▸ CHRM1 P11229 1/20 0.36
▸ KCNQ2 O43526 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ ALDH1A1 P00352 3/20 0.34
▸ KMT2A Q03164 2/20 0.34
▸ NPY1R P25929 1/20 0.34
▸ NPY2R P49146 1/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ PLA2G1B P04054 1/20 0.34
▸ ATG4B Q9Y4P1 1/20 0.34
▸ KDM4E B2RXH2 1/20 0.34
▸ NPSR1 Q6W5P4 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
SCHEMBL18272058 0.95 CHRM3 (0.38) L3MBTL1HTTCHRM3CHRM2CHRM1
SCHEMBL22213482 0.95 L3MBTL1 (0.35) L3MBTL1HTTCHRM3CHRM2CHRM1
SCHEMBL18269756 0.86 LMNA (0.42) L3MBTL1HTTMAPTALDH1A1KMT2A
SCHEMBL16127934 0.84 SCN1A (0.40) KMT2AMEN1LMNA
SCHEMBL20885165 0.82 MTNR1A (0.33) KMT2A
SCHEMBL19712958 0.79 CHRM3 (0.45) L3MBTL1HTTCHRM3CHRM2CHRM1
SCHEMBL22213477 0.77 CHRM3 (0.35) L3MBTL1HTTCHRM3CHRM2CHRM1
SCHEMBL17036157 0.77 LMNA (0.38) L3MBTL1MAPTALDH1A1KMT2AMEN1
SCHEMBL11920351 0.76 MTNR1A (0.36) HTT
SCHEMBL11920353 0.76 AR (0.41) HTTMAPTKMT2AMEN1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2976323-B1 HIGH REFRACTIVE INDEX ADDITION-FRAGMENTATION AGENTS 3M INNOVATIVE PROPERTIES CO (US) 2020-07-15 — — EP disclosed
US-20190105237-A1 HIGH REFRACTIVE INDEX ADDITION-FRAGMENTATION AGENTS 3M INNOVATIVE PROPERTIES CO (US) 2019-04-11 — — US disclosed
US-10195119-B2 High refractive index addition-fragmentation agents 3M INNOVATIVE PROPERTIES COMPANY (US) 2019-02-05 — — US disclosed
US-9730864-B2 Addition-fragmentation oligomers having high refractive index groups 3M INNOVATIVE PROPERTIES COMPANY (US) 2017-08-15 — — US disclosed
US-20160346170-A1 ADDITION-FRAGMENTATION OLIGOMERS HAVING HIGH REFRACTIVE INDEX GROUPS 3M INNOVATIVE PROPERTIES COMPANY 2016-12-01 — — US disclosed
US-20160279033-A1 HIGH REFRACTIVE INDEX ADDITION-FRAGMENTATION AGENTS 3M INNOVATIVE PROPERTIES COMPANY 2016-09-29 — — US disclosed
US-20160279033-A1 HIGH REFRACTIVE INDEX ADDITION-FRAGMENTATION AGENTS 3M INNOVATIVE PROPERTIES COMPANY 2016-09-29 — — US disclosed
WO-2014151363-A1 HIGH REFRACTIVE INDEX ADDITION-FRAGMENTATION AGENTS 3M INNOVATIVE PROPERTIES COMPANY (US) 2014-09-25 — — WO 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 (4 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-20160346170-A1 ADDITION-FRAGMENTATION OLIGOMERS HAVING HIGH REFRACTIVE INDEX GROUPS ZYX, MACF1, PYCARD L3MBTL1 2887/4885HTT 3723/4885CHRM3 3602/4885
US-10195119-B2 High refractive index addition-fragmentation agents EEF1G, FANCI, EEF1E1 L3MBTL1 3569/4885HTT 3800/4885CHRM3 4374/4885
US-20160279033-A1 HIGH REFRACTIVE INDEX ADDITION-FRAGMENTATION AGENTS EEF1G, FANCI, EEF1E1 L3MBTL1 3569/4885HTT 3800/4885CHRM3 4374/4885
US-20190105237-A1 HIGH REFRACTIVE INDEX ADDITION-FRAGMENTATION AGENTS EEF1G, FANCI, EEF1E1 L3MBTL1 3569/4885HTT 3800/4885CHRM3 4374/4885

“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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