SCHEMBL6481569

SCHEMBL6481569

COC(=O)c1c(F)cccc1-c1ccc(C(C)(C)NC(=O)C2(NC(=O)OC(C)(C)C)CC2)cc1

nearest known ligand 0.51

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
BDKRB1 P46663 18/20 0.51
CNR1 P21554 1/20 0.50
BRS3 P32247 2/20 0.41

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
SCHEMBL6185817 0.88 BDKRB1 (0.65) BDKRB1CNR1
SCHEMBL5782528 0.83 BDKRB1 (0.64) BDKRB1CNR1
SCHEMBL6185353 0.78 BDKRB1 (0.52) BDKRB1CNR1BRS3
SCHEMBL6182446 0.75 BDKRB1 (0.46) BDKRB1BRS3
SCHEMBL6184891 0.72 BDKRB1 (0.54) BDKRB1BRS3
SCHEMBL6185454 0.72 BDKRB1 (0.79) BDKRB1
SCHEMBL3120001 0.72 BDKRB1 (0.52) BDKRB1BRS3
SCHEMBL1712893 0.70 BDKRB1 (0.71) BDKRB1CNR1BRS3
SCHEMBL19107200 0.69 OPRM1 (0.43)
SCHEMBL19096292 0.69 OPRM1 (0.43)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6919343-B2 N-biphenyl(substituted methyl) aminocycloalkane-carboxamide derivatives MERCK & CO., INC. (US) 2005-07-19 US disclosed
US-20030220375-A1 N-biphenyl(substituted methyl) aminocycloalkane-carboxamide derivatives MERCK SHARP & DOHME LLC 2003-11-27 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-20030220375-A1 N-biphenyl(substituted methyl) aminocycloalkane-carboxamide derivatives BDKRB1, BDKRB2, CNR2 BDKRB1 1/4885CNR1 9/4885BRS3 52/4885

“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.