SCHEMBL8834212

SCHEMBL8834212

O=C(Cl)CCC(=O)c1ccccc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NR4A2 P43354 1/20 0.68
▸ MAPT P10636 4/20 0.61
▸ L3MBTL1 Q9Y468 3/20 0.61
▸ LMNA P02545 3/20 0.61
▸ TDP1 Q9NUW8 3/20 0.61
▸ ALDH1A1 P00352 4/20 0.61
▸ GAA P10253 1/20 0.61
▸ CYP2C19 P33261 1/20 0.61
▸ MAPK1 P28482 3/20 0.58
▸ HIF1A Q16665 2/20 0.58
▸ GSK3B P49841 2/20 0.58
▸ TRPA1 O75762 1/20 0.58
▸ USP2 O75604 1/20 0.57
▸ POLB P06746 1/20 0.57
▸ HTT P42858 1/20 0.57
▸ NPSR1 Q6W5P4 1/20 0.57
▸ CTNNB1 P35222 1/20 0.57
▸ WNT3A P56704 1/20 0.57
▸ KMT2A Q03164 3/20 0.56
▸ SMN1; SMN2 Q16637 2/20 0.56

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
SCHEMBL719034 0.88 NR4A2 (0.85) NR4A2MAPTL3MBTL1LMNATDP1
SCHEMBL30121738 0.88 NR4A2 (0.85) NR4A2MAPTL3MBTL1LMNATDP1
SCHEMBL7889843 0.87 TDP1 (0.76) NR4A2MAPTL3MBTL1LMNATDP1
SCHEMBL4055319 0.87 TDP1 (0.69) NR4A2MAPTL3MBTL1LMNATDP1
SCHEMBL4476891 0.84 NR4A2 (0.65) NR4A2MAPTL3MBTL1LMNATDP1
SCHEMBL7290443 0.83 NR4A2 (0.63) NR4A2MAPTL3MBTL1LMNATDP1
SCHEMBL8982046 0.82 KMT2A (0.45) NR4A2MAPTL3MBTL1LMNATDP1
SCHEMBL27945874 0.81 ALDH1A1 (0.87) NR4A2MAPTL3MBTL1LMNATDP1
SCHEMBL354105 0.81 NR4A2 (1.00) NR4A2MAPTL3MBTL1LMNATDP1
SCHEMBL28372673 0.80 L3MBTL1 (0.72) NR4A2MAPTL3MBTL1LMNATDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10693073-B2 Fullerene derivatives and organic electronic device comprising fullerene derivatives LG CHEM, LTD. (KR) 2020-06-23 — — US disclosed
EP-3093270-A1 FULLERENE DERIVATIVES AND ORGANIC ELECTRONIC DEVICE COMPRISING FULLERENE DERIVATIVES LG Chem, Ltd. (KR) 2016-11-16 — — EP disclosed
US-20160329498-A1 FULLERENE DERIVATIVES AND ORGANIC ELECTRONIC DEVICE COMPRISING FULLERENE DERIVATIVES LG CHEM, LTD. (KR) 2016-11-10 — — US disclosed
US-5608015-A Processes for producing cyclodextrin derivatives and polymers containing immobilized cyclodextrin therein TOPPAN PRINTING CO., LTD. (JP) 1997-03-04 — — US disclosed
US-4400511-A 2-Substituted octahydropyrrolo(1,2-A)-pyrazine-3-carboxylic acids AMERICAN HOME PRODUCTS CORPORATION (US) 1983-08-23 — — 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-10693073-B2 Fullerene derivatives and organic electronic device comprising fullerene derivatives MDM4, OR10J3, ANXA2 NR4A2 1484/4885MAPT 1120/4885L3MBTL1 2714/4885
US-20160329498-A1 FULLERENE DERIVATIVES AND ORGANIC ELECTRONIC DEVICE COMPRISING FULLERENE DERIVATIVES MDM4, OR10J3, ANXA2 NR4A2 1484/4885MAPT 1120/4885L3MBTL1 2714/4885

“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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