SCHEMBL5589164

SCHEMBL5589164

CCCc1c(O)c(O)c(C2CCCCC2)c(CCC)c1CCC

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 11/20 0.38
CNR2 P34972 11/20 0.38
JAK2 O60674 2/20 0.33
JAK1 P23458 2/20 0.33
TYK2 P29597 2/20 0.33
JAK3 P52333 2/20 0.33
EPHX2 P34913 1/20 0.33
CTSK P43235 3/20 0.32
CTSS P25774 2/20 0.32
GABRA1 P14867 1/20 0.30
GABRG2 P18507 1/20 0.30
GABRB3 P28472 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
SCHEMBL5587912 0.90 CNR1 (0.42) CNR1CNR2JAK2JAK1TYK2
SCHEMBL5588974 0.81 LDHA (0.44) CNR1CNR2JAK2JAK1TYK2
SCHEMBL5587236 0.78 CNR1 (0.36) CNR1CNR2JAK2JAK1TYK2
SCHEMBL5589176 0.78 CNR1 (0.32) CNR1CNR2JAK2JAK1TYK2
SCHEMBL5588260 0.77 LDHA (0.44) CNR1CNR2JAK2JAK1TYK2
SCHEMBL5590702 0.76 LDHA (0.43) CNR1CNR2EPHX2
SCHEMBL5587747 0.73 LDHA (0.39) CNR1CNR2
SCHEMBL5587695 0.72 LDHA (0.40) CNR1CNR2JAK2JAK1TYK2
SCHEMBL5589864 0.72 LDHA (0.46) CNR1CNR2JAK2JAK1TYK2
SCHEMBL3399225 0.70 EPHX2 (0.34) CNR1CNR2EPHX2CTSKCTSS

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 CNR1 3323/4885CNR2 3732/4885JAK2 3079/4885

“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.