SCHEMBL15545336

SCHEMBL15545336

CCC(=O)N[C@H]1CCc2ccc(Br)cc2[C@H]1Cc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 10/20 0.49
SLC6A9 P48067 3/20 0.48
MTNR1A P48039 3/20 0.42
MTNR1B P49286 3/20 0.42
NPY5R Q15761 3/20 0.39
XIAP P98170 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
SCHEMBL16473210 0.87 SLC6A9 (0.52) TRPV1SLC6A9MTNR1AMTNR1BNPY5R
SCHEMBL17399096 0.87 SLC6A9 (0.52) TRPV1SLC6A9MTNR1AMTNR1BNPY5R
SCHEMBL16659175 0.87 SLC6A9 (0.52) TRPV1SLC6A9MTNR1AMTNR1BNPY5R
SCHEMBL9854669 0.86 TRPV1 (0.53) TRPV1SLC6A9MTNR1AMTNR1BNPY5R
SCHEMBL15617046 0.85 TRPV1 (0.54) TRPV1SLC6A9MTNR1AMTNR1BNPY5R
SCHEMBL15617246 0.85 TRPV1 (0.54) TRPV1SLC6A9MTNR1AMTNR1BNPY5R
SCHEMBL15544456 0.85 TRPV1 (0.54) TRPV1SLC6A9MTNR1AMTNR1BNPY5R
SCHEMBL17399094 0.79 TRPV1 (0.43) TRPV1SLC6A9NPY5R
SCHEMBL15544742 0.79 TRPV1 (0.52) TRPV1SLC6A9MTNR1AMTNR1BNPY5R
SCHEMBL17399093 0.76 SLC6A9 (0.42) TRPV1SLC6A9NPY5R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160145197-A1 PROCESS FOR PREPARING BICYCLIC AMINE DERIVATIVES ABBVIE INC. 2016-05-26 US disclosed
US-20160145197-A1 PROCESS FOR PREPARING BICYCLIC AMINE DERIVATIVES ABBVIE INC. 2016-05-26 US disclosed
US-20160145197-A1 PROCESS FOR PREPARING BICYCLIC AMINE DERIVATIVES ABBVIE INC. 2016-05-26 US disclosed
US-9227901-B2 Process for preparing bicyclic amine derivatives ABBVIE INC. (US) 2016-01-05 US disclosed
US-9227901-B2 Process for preparing bicyclic amine derivatives ABBVIE INC. (US) 2016-01-05 US disclosed
US-9227901-B2 Process for preparing bicyclic amine derivatives ABBVIE INC. (US) 2016-01-05 US disclosed
EP-2870132-A1 PROCESS FOR PREPARING BICYCLIC AMINE DERIVATIVES AbbVie Inc. (US) 2015-05-13 EP disclosed
US-20140012015-A1 PROCESS FOR PREPARING BICYCLIC AMINE DERIVATIVES ABBVIE INC. 2014-01-09 US disclosed
WO-2014008350-A1 PROCESS FOR PREPARING BICYCLIC AMINE DERIVATIVES ABBVIE INC. (US) 2014-01-09 WO disclosed
WO-2014008350-A1 PROCESS FOR PREPARING BICYCLIC AMINE DERIVATIVES ABBVIE INC. (US) 2014-01-09 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 (2 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-20160145197-A1 PROCESS FOR PREPARING BICYCLIC AMINE DERIVATIVES HRH4, HRH3, HRH1 TRPV1 3747/4885SLC6A9 2885/4885MTNR1A 3378/4885
US-20140012015-A1 PROCESS FOR PREPARING BICYCLIC AMINE DERIVATIVES HRH4, HRH3, HRH1 TRPV1 3747/4885SLC6A9 2885/4885MTNR1A 3378/4885

“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.