SCHEMBL5950806

SCHEMBL5950806

CC(C)(C)N(C(=O)O)[C@@H]1CCCc2cc(CN3CCCCC3)ccc21

nearest known ligand 0.49

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
BDKRB1 P46663 10/20 0.49
OPRD1 P41143 5/20 0.47

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
SCHEMBL5950809 1.00 BDKRB1 (0.49) BDKRB1OPRD1
SCHEMBL5950807 0.89 BDKRB1 (0.40) BDKRB1OPRD1
SCHEMBL5950808 0.89 BDKRB1 (0.40) BDKRB1OPRD1
SCHEMBL3530897 0.84 KDM4C (0.39) OPRD1
SCHEMBL3530895 0.84 KDM4C (0.39) OPRD1
SCHEMBL3535779 0.77 ACHE (0.41) BDKRB1
SCHEMBL3535777 0.77 ACHE (0.41) BDKRB1
SCHEMBL5183278 0.75 BDKRB1 (0.68) BDKRB1
SCHEMBL12010869 0.75 BDKRB1 (0.43) BDKRB1OPRD1
SCHEMBL13189256 0.75 HRH3 (0.49) BDKRB1

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-20060111347-A1 Substituted sulfones and methods of use AMGEN INC. (US) 2006-05-25 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-20060111347-A1 Substituted sulfones and methods of use SULT2A1, STS, SULT1A1 BDKRB1 419/4885OPRD1 396/4885

“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.