Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 3/20 | 0.41 |
| ▸ | CA9 | Q16790 | 3/20 | 0.41 |
| ▸ | MAOB | P27338 | 2/20 | 0.41 |
| ▸ | MMP1 | P03956 | 5/20 | 0.40 |
| ▸ | MMP2 | P08253 | 5/20 | 0.40 |
| ▸ | MMP9 | P14780 | 5/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | IMPDH2 | P12268 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | CCR2 | P41597 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL3657516 | 0.89 | CA12 (0.44) | CA12CA9MAOBMMP1MMP2 | |
| Trifluoroacetic Acid SCHEMBL3652245 | 0.87 | NPC1 (0.39) | NPC1RAB9AKDM4EMAPTSMN1; SMN2 | |
| Trifluoroacetic Acid SCHEMBL3657860 | 0.82 | RAB9A (0.39) | NPC1RAB9AMAPTSMN1; SMN2LMNA | |
| Trifluoroacetic Acid SCHEMBL3660920 | 0.79 | HRH3 (0.38) | — | |
| Trifluoroacetic Acid SCHEMBL3650438 | 0.79 | — | — | |
| Trifluoroacetic Acid SCHEMBL3705581 | 0.79 | KDM4E (0.40) | NPC1RAB9AKDM4EMAPTKMT2A | |
| Trifluoroacetic Acid SCHEMBL3657556 | 0.79 | HSP90AA1 (0.45) | NPC1RAB9AKDM4EMAPTSMN1; SMN2 | |
| Trifluoroacetic Acid SCHEMBL3656228 | 0.79 | RAB9A (0.46) | NPC1RAB9AMAPTSMN1; SMN2LMNA | |
| Trifluoroacetic Acid SCHEMBL3657956 | 0.77 | HRH3 (0.44) | NPC1RAB9AKDM4EMAPTSMN1; SMN2 | |
| Trifluoroacetic Acid SCHEMBL3650183 | 0.75 | MAPK14 (0.33) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2212282-A1 | SUBSTITUTED N-PHENYL-BIPYRROLIDINE CARBOXAMIDES AND THERAPEUTIC USE THEREOF | Sanofi-Aventis (FR) | 2010-08-04 | — | — | EP | disclosed |
| WO-2009052065-A1 | SUBSTITUTED N-PHENYL-BIPYRROLIDINE CARBOXAMIDES AND THERAPEUTIC USE THEREOF | SANOFI-AVENTIS (FR) | 2009-04-23 | — | — | WO | disclosed |