Predicted protein targets (top 2)
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL30231948 | 1.00 | CALCRL (1.00) | CALCRLCYP3A4 | |
| SCHEMBL3605793 | 1.00 | CALCRL (1.00) | CALCRLCYP3A4 | |
| SCHEMBL3761596 | 0.96 | CALCRL (0.93) | CALCRLCYP3A4 | |
| SCHEMBL30231332 | 0.96 | CALCRL (0.92) | CALCRLCYP3A4 | |
| SCHEMBL13081485 | 0.96 | CALCRL (0.92) | CALCRLCYP3A4 | |
| SCHEMBL3757333 | 0.96 | CALCRL (0.92) | CALCRLCYP3A4 | |
| SCHEMBL3753943 | 0.92 | CALCRL (0.84) | CALCRLCYP3A4 | |
| SCHEMBL3760943 | 0.90 | CALCRL (0.81) | CALCRLCYP3A4 | |
| SCHEMBL14280629 | 0.90 | CALCRL (0.81) | CALCRLCYP3A4 | |
| SCHEMBL30231479 | 0.90 | CALCRL (0.81) | CALCRLCYP3A4 |
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.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7842808-B2 | calcitonin gene-related peptide receptors antagonists such as 4-(2-Oxo-2,3-dihydro-benzoimidazol-1-yl)-piperidine-1-carboxylic acid[2-(1,4-dioxa-8-aza-spiro [4.5]dec-8-yl)-1-(1H-indol-5-ylmethyl)-2-oxo-ethyl]-amide, used for treating headaches, pain, hot flashes or respiratory system disorders | BRISTOL-MYERS SQUIBB COMPANY (US) | 2010-11-30 | — | — | US | disclosed |
| US-7220862-B2 | Calcitonin gene related peptide receptor antagonists | BRISTOL-MYERS SQUIBB COMPANY (US) | 2007-05-22 | — | — | US | disclosed |