Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 3/20 | 0.38 |
| ▸ | CA2 | P00918 | 3/20 | 0.38 |
| ▸ | CA7 | P43166 | 2/20 | 0.38 |
| ▸ | CA9 | Q16790 | 2/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA4 | P22748 | 1/20 | 0.38 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.38 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.35 |
| ▸ | KCNK9 | Q9NPC2 | 1/20 | 0.35 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.32 |
| ▸ | TP53 | P04637 | 2/20 | 0.32 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL622920 | 0.86 | DDB1 (0.34) | GAAALDH1A1L3MBTL1KDM4E | |
| SCHEMBL1067882 | 0.85 | KCNK3 (0.35) | CA1CA2CA7CA9CA12 | |
| SCHEMBL17046331 | 0.84 | KCNH2 (0.31) | — | |
| SCHEMBL17046260 | 0.81 | KCNK3 (0.40) | KCNK3KCNK9ALDH1A1 | |
| SCHEMBL16956116 | 0.81 | ALDH1A1 (0.38) | NPSR1ALDH1A1TDP1L3MBTL1MAPT | |
| SCHEMBL21268343 | 0.80 | AR (0.36) | MEN1KMT2ATSHRHTTHSD17B10 | |
| SCHEMBL123985 | 0.80 | CA1 (0.48) | CA1CA2CA7CA9CA12 | |
| SCHEMBL1068899 | 0.79 | SLC22A12 (0.32) | — | |
| SCHEMBL17046335 | 0.78 | HCRTR1 (0.34) | MEN1GAAKMT2AHTTALDH1A1 | |
| SCHEMBL28053410 | 0.78 | CA1 (0.46) | CA1CA2CA7CA9CA12 |
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 18 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0737194-B1 | DIAZABICYCLIC NEUROKININ ANTAGONISTS | PFIZER (US) | 1999-03-03 | — | — | EP | claimed |
| US-5854239-A | Diazabicyclic neuokinin antagonists | PFIZER INC. (US) | 1998-12-29 | — | — | US | claimed |
| EP-0737194-A1 | DIAZABICYCLIC NEUROKININ ANTAGONISTS | PFIZER INC. (US) | 1996-10-16 | — | — | EP | claimed |
| WO-1995018129-A1 | DIAZABICYCLIC NEUROKININ ANTAGONISTS | PFIZER INC. (US) | 1995-07-06 | — | — | WO | claimed |
| US-20200392107-A1 | CYCLIC AMINE DERIVATIVE AND MEDICAL USE THEREOF | TORAY INDUSTRIES, INC. (JP) | 2020-12-17 | — | — | US | disclosed |
| EP-3747879-A1 | CYCLIC AMINE DERIVATIVE AND PHARMACEUTICAL USE THEREOF | Toray Industries, Inc. (JP) | 2020-12-09 | — | — | EP | disclosed |
| EP-2900645-B1 | HERBICIDAL AND FUNGICIDAL 3-PHENYLISOXAZOLIN DERIVATIVES | BAYER CROPSCIENCE AG (DE) | 2019-08-21 | — | — | EP | disclosed |
| EP-3167716-A1 | SUBSTITUTED OXADIAZOLES FOR COMBATING PHYTOPATHOGENIC FUNGI | BASF SE (DE) | 2017-05-17 | — | — | EP | disclosed |
| US-9585392-B2 | 3-phenylisoxazolin derivatives with herbicidal action | BAYER CROPSCIENCE AG (DE) | 2017-03-07 | — | — | US | disclosed |
| US-20150245615-A1 | 3-PHENYLISOXAZOLIN DERIVATIVES WITH HERBICIDAL ACTION | BAYER CROPSCIENCE AG (DE) | 2015-09-03 | — | — | US | disclosed |
| CN-104245689-A | Tetrazolinone compounds and its use as pesticides | SUMITOMO CHEMICAL CO | 2014-12-24 | — | — | CN | disclosed |
| WO-2011006886-A2 | AZOLE COMPOUNDS CARRYING A SULFUR SUBSTITUENT XIV | BASF SE (DE) | 2011-01-20 | — | — | WO | disclosed |
| WO-2010149758-A1 | ANTIFUNGAL 1, 2, 4-TRIAZOLYL DERIVATIVES | BASF SE (DE) | 2010-12-29 | — | — | WO | disclosed |
| US-6110919-A | Diazabicyclic neurokinin antagonists | PFIZER INC. (US) | 2000-08-29 | — | — | US | disclosed |
| EP-0737194-B1 | DIAZABICYCLIC NEUROKININ ANTAGONISTS | PFIZER (US) | 1999-03-03 | — | — | EP | disclosed |
| US-5854239-A | Diazabicyclic neuokinin antagonists | PFIZER INC. (US) | 1998-12-29 | — | — | US | disclosed |
| EP-0737194-A1 | DIAZABICYCLIC NEUROKININ ANTAGONISTS | PFIZER INC. (US) | 1996-10-16 | — | — | EP | disclosed |
| WO-1995018129-A1 | DIAZABICYCLIC NEUROKININ ANTAGONISTS | PFIZER INC. (US) | 1995-07-06 | — | — | 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.
| Patent | Title | Text reads most about | Predicted target · text-rank |
|---|---|---|---|
| US-20200392107-A1 | CYCLIC AMINE DERIVATIVE AND MEDICAL USE THEREOF | NPR3, SLC10A1, CNR2 | CA1 1526/4885CA2 580/4885CA7 1211/4885 |
| US-20150245615-A1 | 3-PHENYLISOXAZOLIN DERIVATIVES WITH HERBICIDAL ACTION | CYP4X1, CBR3, PAOX | CA1 571/4885CA2 86/4885CA7 167/4885 |
“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.