Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM4 | Q14833 | 1/20 | 0.48 |
| ▸ | EPHX1 | P07099 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | NAAA | Q02083 | 1/20 | 0.40 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.40 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.40 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.40 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.40 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.40 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.39 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.39 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.39 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.39 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.39 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 2/20 | 0.37 |
| ▸ | PRCP | P42785 | 1/20 | 0.36 |
| ▸ | BCHE | P06276 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL2521351 | 1.00 | GRM4 (0.48) | GRM4EPHX1KDM4EALDH1A1NAAA | |
| SCHEMBL4295164 | 0.89 | CHRNB2 (0.46) | GRM4EPHX1KDM4EALDH1A1NAAA | |
| SCHEMBL11616912 | 0.86 | NAAA (0.53) | EPHX1NAAAPOLBPRCP | |
| SCHEMBL11616910 | 0.86 | NAAA (0.53) | EPHX1NAAAPOLBPRCP | |
| SCHEMBL16767823 | 0.84 | PSEN1 (0.44) | GRM4KDM4EPSEN1PSEN2APH1B | |
| SCHEMBL21253759 | 0.84 | MC4R (0.39) | ALDH1A1PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL18273734 | 0.81 | SIGMAR1 (0.37) | GRM4PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL18273730 | 0.81 | SIGMAR1 (0.37) | GRM4PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL18273732 | 0.80 | PSEN1 (0.36) | GRM4EPHX1PSEN1PSEN2APH1B | |
| SCHEMBL4598377 | 0.80 | TAAR1 (0.40) | GRM4ALDH1A1POLB |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8623887-B2 | Compounds | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2014-01-07 | — | — | US | disclosed |
| US-8466318-B2 | Method of preparing chiral cyclic β-aminocarboxamides | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2013-06-18 | — | — | US | disclosed |
| EP-2109605-B1 | 2- [(PHENYLAMINO) -PYRIMIDIN-4YLAMIN0] -CYCLOPENTANE CARBOXAMIDE DERIVATIVES AND RELATED COMPOUNDS AS INHIBITORS OF KINASES OF THE CELL CYCLE FOR THE TREATMENT OF CANCER | BOEHRINGER INGELHEIM INT (DE) | 2013-02-20 | — | — | EP | disclosed |
| EP-2027083-B1 | METHOD OF PREPARING CHIRAL CYCLIC BETA-AMINOCARBOXAMIDES | BOEHRINGER INGELHEIM INT (DE) | 2012-07-11 | — | — | EP | disclosed |
| US-20100144706-A1 | Compounds | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2010-06-10 | — | — | US | disclosed |
| US-20090209787-A1 | METHOD OF PREPARING CHIRAL CYCLIC BETA-AMINOCARBOXAMIDES | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2009-08-20 | — | — | US | disclosed |
| US-20090163467-A1 | New compounds | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2009-06-25 | — | — | 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 (3 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-20100144706-A1 | Compounds | MKI67, CCNA1, CCNT1 | GRM4 2671/4885EPHX1 443/4885KDM4E 1828/4885 |
| US-20090209787-A1 | METHOD OF PREPARING CHIRAL CYCLIC BETA-AMINOCARBOXAMIDES | PRMT1, CCNT1, CCNA1 | GRM4 2463/4885EPHX1 671/4885KDM4E 716/4885 |
| US-20090163467-A1 | New compounds | CCNA1, MKI67, CCNT1 | GRM4 3393/4885EPHX1 721/4885KDM4E 2552/4885 |
“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.