SCHEMBL5589470

SCHEMBL5589470

O=C(O)Oc1cccc(CC(I)I)c1O

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 2/20 0.38
GABRB2 P47870 2/20 0.38
IDO1 P14902 1/20 0.34
ALOX5 P09917 1/20 0.33
PTGS2 P35354 1/20 0.33
GAA P10253 1/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
ELANE P08246 1/20 0.32
CALM1 P0DP23 1/20 0.32
HMGB1 P09429 1/20 0.32
PPARG P37231 1/20 0.31
PPARA Q07869 1/20 0.31
DUSP3 P51452 1/20 0.31
PTPN5 P54829 1/20 0.31
PTPN11 Q06124 1/20 0.31
CTDSP1 Q9GZU7 1/20 0.31
AKR1B1 P15121 1/20 0.31

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
SCHEMBL5587674 0.84 ALOX5 (0.38) GABRA1GABRB2IDO1ALOX5PTGS2
SCHEMBL5589414 0.84 GABRA1 (0.38) GABRA1GABRB2IDO1ALOX5PTGS2
SCHEMBL5589846 0.84 GABRA1 (0.38) GABRA1GABRB2IDO1ALOX5PTGS2
SCHEMBL5587991 0.84 GABRA1 (0.38) GABRA1GABRB2IDO1ALOX5PTGS2
SCHEMBL5588249 0.82 ALOX5 (0.42) ALOX5PTGS2HMGB1PPARGPPARA
SCHEMBL5587910 0.81 GAA (0.38) GABRA1GABRB2IDO1ALOX5PTGS2
SCHEMBL5589379 0.81 ALOX5 (0.44) ALOX5PTGS2HMGB1PPARGPPARA
SCHEMBL5586877 0.80 ALOX5 (0.43) ALOX5PTGS2PPARGPPARA
SCHEMBL5587505 0.80 ALOX5 (0.43) ALOX5PTGS2PPARGPPARA
SCHEMBL5588996 0.80 ALOX5 (0.43) ALOX5PTGS2PPARGPPARA

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-7247687-B2 Late transition metal catalysts for olefin polymerization and oligomerization EXXONMOBIL CHEMICAL PATENTS INC. (US) 2007-07-24 US disclosed
EP-1521758-B1 LATE TRANSITION METAL CATALYSTS FOR OLEFIN POLYMERIZATION AND OLIGOMERIZATION EXXONMOBIL CHEM PATENTS INC (US) 2006-05-24 EP disclosed
US-20060047094-A1 Late transition metal catalysts for olefin polymerization and oligomerization EXXONMOBIL CHEMICAL PATENTS INC. 2006-03-02 US disclosed
EP-1521758-A1 LATE TRANSITION METAL CATALYSTS FOR OLEFIN POLYMERIZATION AND OLIGOMERIZATION Exxonmobil Chemical Patents Inc. (US) 2005-04-13 EP disclosed
WO-2004007509-A1 LATE TRANSITION METAL CATALYSTS FOR OLEFIN POLYMERIZATION AND OLIGOMERIZATION EXXONMOBIL CHEMICAL PATENTS INC. (US) 2004-01-22 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 (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-20060047094-A1 Late transition metal catalysts for olefin polymerization and oligomerization MLX, LOX, LMTK3 GABRA1 3688/4885GABRB2 3686/4885IDO1 425/4885

“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.