SCHEMBL4931769

SCHEMBL4931769

O=C(O)c1nn(-c2ccc(F)cc2Cl)c2c1C1CCC2C1

nearest known ligand 0.58

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 15/20 0.58
CNR1 P21554 6/20 0.58
MARS1 P56192 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.38
MAPK14 Q16539 1/20 0.36
RBP4 P02753 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
SCHEMBL1431958 0.88 CNR2 (0.72) CNR2CNR1
SCHEMBL1431791 0.88 CNR2 (0.47) CNR2CNR1MARS1
SCHEMBL4931402 0.88 CNR2 (0.72) CNR2CNR1
SCHEMBL4934195 0.88 CNR2 (0.72) CNR2CNR1
SCHEMBL4927367 0.84 CNR2 (0.82) CNR2CNR1
SCHEMBL4931540 0.84 CNR1 (0.54) CNR2CNR1SMN1; SMN2
SCHEMBL4933157 0.84 CNR2 (0.58) CNR2CNR1MARS1
SCHEMBL4929203 0.84 CNR2 (0.58) CNR2CNR1MARS1
SCHEMBL4934269 0.84 CNR2 (0.58) CNR2CNR1MARS1
SCHEMBL1432530 0.83 CNR1 (0.43) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080200501-A1 NOVEL CANNABINOID RECEPTOR LIGANDS, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM, AND PROCESSES FOR THEIR PREPARATION GLENMARK PHARMACEUTICALS S.A. (CH) 2008-08-21 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-20080200501-A1 NOVEL CANNABINOID RECEPTOR LIGANDS, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM, AND PROCESSES FOR THEIR PREPARATION CNR2, CNR1, OPRL1 CNR2 1/4885CNR1 2/4885MARS1 4429/4885

“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.