SCHEMBL5769839

SCHEMBL5769839

CCOC(=O)c1nn(-c2ccccc2Cl)c(Oc2ccc(Cl)cc2)c1CNC1CCCCC1

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 3/20 0.46
PDE4A P27815 2/20 0.46
PDE4C Q08493 2/20 0.46
PDE4D Q08499 2/20 0.46
CNR1 P21554 8/20 0.45
FAAH O00519 5/20 0.43
CNR2 P34972 5/20 0.42
MGLL Q99685 1/20 0.41
OPRL1 P41146 1/20 0.40

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
SCHEMBL5768924 1.00 PDE4B (0.46) PDE4BPDE4APDE4CPDE4DCNR1
SCHEMBL5769821 0.91 CNR1 (0.50) CNR1FAAHCNR2OPRL1
SCHEMBL5769885 0.91 CNR1 (0.48) CNR1CNR2OPRL1
SCHEMBL6766010 0.91 CNR1 (0.48) CNR1CNR2OPRL1
SCHEMBL5767881 0.88 CNR1 (0.49) CNR1CNR2
SCHEMBL5768237 0.87 CNR1 (0.49) CNR1CNR2
SCHEMBL5768407 0.87 CNR1 (0.59) CNR1CNR2
SCHEMBL6765658 0.87 CNR1 (0.59) CNR1CNR2
SCHEMBL5767412 0.87 CNR1 (0.59) CNR1CNR2
SCHEMBL5768236 0.87 CNR1 (0.49) CNR1CNR2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040235926-A1 Cannabinoid receptor ligands and uses thereof PFIZER INC. 2004-11-25 US claimed
EP-1622876-A1 CANNABINOID RECEPTOR LIGANDS AND USES THEREOF Pfizer Products Inc. (US) 2006-02-08 EP disclosed
US-20040235926-A1 Cannabinoid receptor ligands and uses thereof PFIZER INC. 2004-11-25 US disclosed
WO-2004099157-A1 CANNABINOID RECEPTOR LIGANDS AND USES THEREOF PFIZER PRODUCTS INC. (US) 2004-11-18 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-20040235926-A1 Cannabinoid receptor ligands and uses thereof CNR1, CNR2, GPR18 PDE4B 2564/4885PDE4A 2454/4885PDE4C 2921/4885

“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.