SCHEMBL5589448

SCHEMBL5589448

CCCCc1c(O)c(O)c(I)c(I)c1I

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.41
MAPK1 P28482 2/20 0.41
NPC1 O15118 1/20 0.41
HTT P42858 1/20 0.41
RAB9A P51151 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
FFAR1 O14842 1/20 0.37
KDM4E B2RXH2 3/20 0.34
PKM P14618 1/20 0.34
ALDH1A1 P00352 2/20 0.33
HSD17B10 Q99714 1/20 0.33
ALOX5 P09917 5/20 0.33
PLA2G2A P14555 1/20 0.32
PLA2G5 P39877 1/20 0.32
TYR P14679 2/20 0.32
LMNA P02545 1/20 0.31
CCNB2 O95067 1/20 0.30
CCNE2 O96020 1/20 0.30
INSR P06213 1/20 0.30
CDK1 P06493 1/20 0.30

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
SCHEMBL5587981 0.94 ALOX5 (0.39) HPGDMAPK1NPC1HTTRAB9A
SCHEMBL5589418 0.92 ALOX5 (0.41) KDM4EALDH1A1HSD17B10ALOX5PLA2G2A
SCHEMBL5586742 0.92 ALOX5 (0.41) KDM4EALDH1A1HSD17B10ALOX5PLA2G2A
SCHEMBL5587943 0.92 ALOX5 (0.41) KDM4EALDH1A1HSD17B10ALOX5PLA2G2A
SCHEMBL5590395 0.92 ALOX5 (0.41) KDM4EALDH1A1HSD17B10ALOX5PLA2G2A
SCHEMBL5588634 0.92 ALOX5 (0.41) KDM4EALDH1A1HSD17B10ALOX5PLA2G2A
SCHEMBL5589559 0.91 HPGD (0.41) HPGDMAPK1NPC1HTTRAB9A
SCHEMBL5586679 0.86 LDHA (0.33) HPGDKDM4EALDH1A1
SCHEMBL5592657 0.85 ALOX5 (0.39) HPGDMAPK1NPC1HTTRAB9A
SCHEMBL5587308 0.83 ALOX5 (0.41) KDM4EALDH1A1HSD17B10ALOX5PLA2G2A

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 HPGD 2689/4885MAPK1 2374/4885NPC1 3851/4885

“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.