SCHEMBL4080153

SCHEMBL4080153

O=C(c1c(F)cccc1NC(=O)C12CC3CC(CC(C3)O1)C2)N1CC(F)(F)C1

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 9/20 0.44
P2RX7 Q99572 1/20 0.38
RAB9A P51151 1/20 0.38
KMT2A Q03164 1/20 0.38
CNR2 P34972 3/20 0.37
CNR1 P21554 2/20 0.37
ALDH1A1 P00352 2/20 0.36
PDE10A Q9Y233 1/20 0.35

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
SCHEMBL3683223 0.82 CNR2 (0.52) EPHX2P2RX7RAB9AKMT2ACNR2
SCHEMBL4080157 0.82 EPHX2 (0.37) EPHX2P2RX7RAB9AKMT2ACNR2
SCHEMBL4090752 0.82 EPHX2 (0.38) EPHX2RAB9AKMT2ACNR2CNR1
SCHEMBL4084463 0.77 SERPINE1 (0.42) EPHX2P2RX7RAB9ACNR2CNR1
SCHEMBL4089688 0.75 GPR6 (0.34) EPHX2CNR2CNR1ALDH1A1
SCHEMBL3690631 0.73 CNR2 (0.51) EPHX2P2RX7KMT2ACNR2CNR1
SCHEMBL4090110 0.73 CNR2 (0.59) CNR2CNR1ALDH1A1
SCHEMBL3684785 0.71 CNR2 (0.51) EPHX2P2RX7KMT2ACNR2CNR1
SCHEMBL2162085 0.71 CNR2 (0.61) CNR2CNR1
SCHEMBL4091419 0.71 CNR2 (0.74) CNR2CNR1

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-20090018114-A1 NOVEL COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS ABBOTT LABORATORIES (US) 2009-01-15 US claimed
US-8338623-B2 N-{3-[(2,5-dimethylmorpholin-4-yl)carbonyl]-4,7-dihydro-5H-thieno[2,3-c]pyran-2-yl}hexahydro-2,5-methanopentalene-3a(1H)-carboxamide; CB2 receptors ligand; antiinflammatory, analgesic agent; autoimmune diseases; neuroprotectants ABBVIE INC. (US) 2012-12-25 US disclosed
US-20090018114-A1 NOVEL COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS ABBOTT LABORATORIES (US) 2009-01-15 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-20090018114-A1 NOVEL COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS CNR1, CNR2, GPR18 EPHX2 656/4885P2RX7 340/4885RAB9A 1141/4885

“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.