SCHEMBL6006517

SCHEMBL6006517

CCCCCC(N[C]=O)C(=O)OCCCC

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.41
ZDHHC7 Q9NXF8 1/20 0.41
TSHR P16473 3/20 0.41
MAPT P10636 1/20 0.41
HPGD P15428 1/20 0.41
NOD1 Q9Y239 3/20 0.40
EPHX1 P07099 1/20 0.40
ATM Q13315 1/20 0.39
NAAA Q02083 1/20 0.38
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
FAAH O00519 1/20 0.36
ACHE P22303 4/20 0.35

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
SCHEMBL6006458 0.83 CA1 (0.42) ZDHHC7TSHRMAPTNOD1ATM
SCHEMBL222755 0.81 CA1 (0.52) ZDHHC7TSHRATMCA1CA2
SCHEMBL7495908 0.75 ALDH1A1 (0.33) ALDH1A1TSHRCA1CA2
SCHEMBL7657099 0.75 TSHR (0.47) ALDH1A1TSHRATM
SCHEMBL6946567 0.75 TSHR (0.47) ALDH1A1TSHRATM
SCHEMBL28007283 0.73 EPHX1 (0.43) ALDH1A1ZDHHC7NOD1EPHX1NAAA
SCHEMBL8095959 0.73 NOD1 (0.54) ZDHHC7TSHRMAPTNOD1EPHX1
SCHEMBL6005311 0.73 CA1 (0.41) ZDHHC7TSHRCA1CA2
SCHEMBL27574678 0.72 ZDHHC7 (0.47) ZDHHC7MAPTNOD1EPHX1NAAA
SCHEMBL9340085 0.72 MAPT (0.47) ALDH1A1ZDHHC7TSHRMAPTHPGD

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
EP-1207161-B1 NOVEL ISOINDOLE DERIVATIVES BANYU PHARMA CO LTD (JP) 2006-01-18 EP disclosed
US-6777410-B2 SUCH AS 9-(2-METHOXYPHENYL)-3-(1-METHYLETHYL)-(1,3)OXAZOLO-(2,3)ISOINDOLE-2,5(3H,9H)-DIONE; DIABETES AND COMPLICATIONS; OBESITY BANYU PHARMACEUTICAL CO., LTD. (JP) 2004-08-17 US disclosed
US-20040053923-A1 Novel isoindole derivatives BANYU PHARMACEUTICAL CO., LTD. 2004-03-18 US disclosed
US-6608098-B1 Diabetes or obesity, 2-(4-(3-isopropyl-2,5-dioxo-2,3-dihydro-1H-pyrrolo(2,1-a) isoindol-9(5H)-yl)phenoxy)-N-propylacetamide BANYU PHARMACEUTICAL CO., LTD. (JP) 2003-08-19 US disclosed
EP-1207161-A1 NOVEL ISOINDOLE DERIVATIVES BANYU PHARMACEUTICAL CO., LTD. (JP) 2002-05-22 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-20040053923-A1 Novel isoindole derivatives GPR119, SLC5A2, SLC5A1 ALDH1A1 228/4885ZDHHC7 211/4885TSHR 2490/4885

“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.