SCHEMBL6154246

SCHEMBL6154246

NCC(=O)N1C2CCC1CC(Oc1ccc(F)cc1)C2

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
OPRK1 P41145 3/20 0.44
KCNH2 Q12809 3/20 0.44
NAAA Q02083 1/20 0.44
GRIN1 Q05586 4/20 0.44
GRIN2B Q13224 4/20 0.44
OPRM1 P35372 1/20 0.42
EPHX2 P34913 2/20 0.41
HRH3 Q9Y5N1 3/20 0.40
ADRB2 P07550 1/20 0.40
SLC6A3 Q01959 2/20 0.40
SLC6A2 P23975 1/20 0.39

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
SCHEMBL6762868 1.00 OPRK1 (0.44) OPRK1KCNH2NAAAGRIN1GRIN2B
SCHEMBL6154249 1.00 OPRK1 (0.44) OPRK1KCNH2NAAAGRIN1GRIN2B
SCHEMBL6761241 0.88 NAAA (0.45) OPRK1KCNH2NAAAGRIN1GRIN2B
SCHEMBL6761237 0.88 NAAA (0.45) OPRK1KCNH2NAAAGRIN1GRIN2B
SCHEMBL6761414 0.86 OPRK1 (0.44) OPRK1KCNH2NAAAGRIN1GRIN2B
SCHEMBL6761413 0.86 OPRK1 (0.44) OPRK1KCNH2NAAAGRIN1GRIN2B
SCHEMBL6760350 0.83 NAAA (0.47) OPRK1KCNH2NAAAGRIN1GRIN2B
SCHEMBL6760352 0.83 NAAA (0.47) OPRK1KCNH2NAAAGRIN1GRIN2B
SCHEMBL20958268 0.83 NAAA (0.47) OPRK1KCNH2NAAAGRIN1GRIN2B
SCHEMBL20958266 0.83 NAAA (0.47) OPRK1KCNH2NAAAGRIN1GRIN2B

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
EP-1525201-A1 BICYCLIC PIPERIDINE DERIVATIVES AS ANTAGONISTS OF THE CCR1 CHEMOKINE RECEPTOR Pfizer Products Inc. (US) 2005-04-27 EP disclosed
US-20040063688-A1 Novel piperidine derivatives PFIZER INC. 2004-04-01 US disclosed
WO-2004009588-A1 BICYCLIC PIPERIDINE DERIVATIVES AS ANTAGONISTS OF THE CCR1 CHEMOKINE RECEPTOR PFIZER PRODUCTS INC. (US) 2004-01-29 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-20040063688-A1 Novel piperidine derivatives CCR1, CCR3, CCR2 OPRK1 57/4885KCNH2 1989/4885NAAA 4622/4885

“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.