SCHEMBL5589644

SCHEMBL5589644

CC(C)Cc1cc(CC(C)C)c(F)c(OC(=O)O)c1O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 2/20 0.36
GABRB2 P47870 2/20 0.36
HSP90AA1 P07900 1/20 0.32
HSP90AB1 P08238 1/20 0.32
ALOX15 P16050 4/20 0.32
USP2 O75604 2/20 0.32
MEN1 O00255 2/20 0.32
LMNA P02545 2/20 0.32
HPGD P15428 2/20 0.32
KMT2A Q03164 2/20 0.32
ALDH1A1 P00352 2/20 0.32
RGS12 O14924 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2C9 P11712 1/20 0.32
PKM P14618 1/20 0.32
NFKB1 P19838 1/20 0.32
CASP1 P29466 1/20 0.32
BRCA1 P38398 1/20 0.32
THPO P40225 1/20 0.32
CASP7 P55210 1/20 0.32

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
SCHEMBL5588042 0.83 GABRA1 (0.37) GABRA1GABRB2HSP90AA1HSP90AB1ALOX15
SCHEMBL5588410 0.82 GABRA1 (0.36) GABRA1GABRB2HSP90AA1HSP90AB1ALOX15
SCHEMBL5587188 0.78 GABRA1 (0.48) GABRA1GABRB2HSP90AA1HSP90AB1LMNA
SCHEMBL5589457 0.77 ALOX12 (0.38) GABRA1GABRB2ALOX15MEN1LMNA
SCHEMBL5588613 0.77 GABRA1 (0.34) GABRA1GABRB2HSP90AA1HSP90AB1ALOX15
SCHEMBL5587790 0.75 TYR (0.38) GABRA1GABRB2
SCHEMBL5589640 0.75 GABRA1 (0.47) GABRA1GABRB2HSP90AA1HSP90AB1ALOX15
SCHEMBL5587156 0.74 ALOX15 (0.35) GABRA1GABRB2HSP90AA1HSP90AB1ALOX15
SCHEMBL5588821 0.73 IMPDH2 (0.30)
SCHEMBL5588288 0.71 GABRA1 (0.44) GABRA1GABRB2ALOX15LMNAALDH1A1

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 3 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

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 3686/4885HSP90AA1 4349/4885

“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.