SCHEMBL6025253

SCHEMBL6025253

CC(=O)C1(c2ccccc2)CCN(C(=O)c2ncc(-c3ccc(Cl)cc3)c(-c3ccc(Cl)cc3Cl)n2)CC1

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CNR1 P21554 9/20 0.48
▸ CCKAR P32238 2/20 0.46
▸ CNR2 P34972 3/20 0.46
▸ TACR1 P25103 1/20 0.44
▸ CYP46A1 Q9Y6A2 1/20 0.40
▸ CA12 O43570 1/20 0.40
▸ CA1 P00915 1/20 0.40
▸ CA2 P00918 1/20 0.40
▸ CA7 P43166 1/20 0.40
▸ CA9 Q16790 1/20 0.40
▸ CA14 Q9ULX7 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
SCHEMBL6025637 0.90 CNR1 (0.53) CNR1CCKARCNR2
SCHEMBL6024749 0.85 CNR1 (0.47) CNR1CCKARCA12CA1CA2
SCHEMBL6025648 0.81 CNR1 (0.56) CNR1CCKARCNR2
SCHEMBL6807596 0.81 CNR1 (0.71) CNR1CNR2
SCHEMBL5111599 0.81 CNR1 (0.54) CNR1CNR2TACR1CA12CA1
SCHEMBL6808103 0.80 CNR1 (0.51) CNR1CCKARCNR2
SCHEMBL6808358 0.80 CNR1 (0.48) CNR1CCKARCNR2
SCHEMBL6026092 0.79 CNR1 (0.56) CNR1CCKAR
SCHEMBL6025823 0.79 CNR1 (0.56) CNR1CCKARCNR2
SCHEMBL5105879 0.79 CNR1 (0.54) CNR1CNR2TACR1CA12CA1

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-20040259887-A1 Cannabinoid receptor ligands and uses thereof PFIZER INC 2004-12-23 — — US claimed
EP-1638570-A1 PYRIMIDINE DERIVATIVES AS CANNABINOID RECEPTOR LIGANDS Pfizer Products Inc. (US) 2006-03-29 — — EP disclosed
US-20040259887-A1 Cannabinoid receptor ligands and uses thereof PFIZER INC 2004-12-23 — — US disclosed
WO-2004110453-A1 PYRIMIDINE DERIVATIVES AS CANNABINOID RECEPTOR LIGANDS PFIZER PRODUCTS INC. (US) 2004-12-23 — — 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-20040259887-A1 Cannabinoid receptor ligands and uses thereof CNR1, CNR2, GPR18 CNR1 1/4885CCKAR 54/4885CNR2 2/4885

“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.

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