SCHEMBL5587071

SCHEMBL5587071

CC(C)Cc1c(O)c(O)c(CC(C)C)c(Cl)c1Cl

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 3/20 0.39
GABRB2 P47870 2/20 0.39
MCL1 Q07820 4/20 0.36
BCL2 P10415 3/20 0.36
CFTR P13569 1/20 0.35
CYP1A2 P05177 3/20 0.33
HIF1A Q16665 3/20 0.33
CYP2C9 P11712 2/20 0.33
CYP3A4 P08684 2/20 0.33
BAD Q92934 1/20 0.33
TSHR P16473 3/20 0.32
MEN1 O00255 2/20 0.32
LMNA P02545 2/20 0.32
MAPT P10636 2/20 0.32
HPGD P15428 2/20 0.32
KMT2A Q03164 2/20 0.32
HSD17B10 Q99714 2/20 0.32
ALDH1A1 P00352 1/20 0.32
ALOX15 P16050 2/20 0.31
ALOX12 P18054 2/20 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
SCHEMBL13173812 0.80
SCHEMBL6157348 0.78 GABRA1 (0.42) GABRA1GABRB2MCL1BCL2CFTR
SCHEMBL5590108 0.74 GABRA1 (0.39) GABRA1GABRB2MCL1BCL2BAD
SCHEMBL5588820 0.74 GABRA1 (0.39) GABRA1GABRB2MCL1BCL2BAD
SCHEMBL5589544 0.74 CA1 (0.40) GABRA1GABRB2MCL1BCL2HIF1A
SCHEMBL5587604 0.72 GABRA1 (0.44) GABRA1GABRB2MCL1BCL2CFTR
SCHEMBL13173786 0.70
SCHEMBL5587062 0.70 GABRA1 (0.37) GABRA1GABRB2MCL1BCL2CYP3A4
SCHEMBL5589648 0.67 GABRA1 (0.34) GABRA1GABRB2MCL1BCL2HPGD
SCHEMBL5588405 0.66 GABRA1 (0.47) GABRA1GABRB2TSHRHPGDHSD17B10

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 3686/4885MCL1 1660/4885

“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.