Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Oxalic Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 20/20 | 0.59 |
| ▸ | CYP2D6 | P10635 | 7/20 | 0.59 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.59 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.59 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.59 |
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 | |
|---|---|---|---|---|
| Oxalic Acid SCHEMBL18006704 | 1.00 | CYP3A4 (0.59) | CYP3A4CYP2D6CYP2C9CYP2C19ABCG2 | |
| SCHEMBL13093532 | 0.97 | CYP3A4 (0.59) | CYP3A4CYP2D6CYP2C9CYP2C19ABCG2 | |
| Oxalic Acid SCHEMBL18006650 | 0.93 | CYP3A4 (0.60) | CYP3A4CYP2D6CYP2C9CYP2C19ABCG2 | |
| Oxalic Acid SCHEMBL18006651 | 0.93 | CYP3A4 (0.60) | CYP3A4CYP2D6CYP2C9CYP2C19ABCG2 | |
| Oxalic Acid SCHEMBL15847967 | 0.91 | CYP3A4 (0.59) | CYP3A4CYP2D6CYP2C9CYP2C19ABCG2 | |
| Oxalic Acid SCHEMBL15847964 | 0.91 | CYP3A4 (0.59) | CYP3A4CYP2D6CYP2C9CYP2C19ABCG2 | |
| SCHEMBL2736234 | 0.91 | CYP3A4 (0.60) | CYP3A4CYP2D6CYP2C9CYP2C19ABCG2 | |
| SCHEMBL18018759 | 0.91 | CYP3A4 (0.60) | CYP3A4CYP2D6CYP2C9CYP2C19ABCG2 | |
| SCHEMBL2760187 | 0.90 | CYP3A4 (0.57) | CYP3A4CYP2D6CYP2C9CYP2C19ABCG2 | |
| SCHEMBL10201699 | 0.90 | CYP3A4 (0.57) | CYP3A4CYP2D6CYP2C9CYP2C19ABCG2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-10351556-B2 | Process for the preparation of 1,3-thiazol-5-ylmethyl [(2R,5R)-5-{[(2s)-2-[(methyl{[2-(propan-2-yl)-1,3-thiazol-4YL] methyl} carbamoyl) amino]-4-(morpholin-4-yl)butanoyl]amino)-1,6-diphenylhexan-2-yl]carbamate | MSN LABORATORIES PRIVATE LIMITED (IN) | 2019-07-16 | — | — | US | disclosed |
| US-20180030043-A1 | NOVEL PROCESS FOR THE PREPARATION OF 1,3-THIAZOL-5-YLMETHYL [(2R,5R)-5- CARBAMOYL) AMINO] -4-(MORPHOLIN-4-YL)BUTANOYL]AMINO}-1,6-DIPHENYLHEXAN-2-YL]CARBAMATE | MSN LABORATORIES PRIVATE LIMITED (IN) | 2018-02-01 | — | — | US | disclosed |
| EP-3259267-A2 | NOVEL PROCESS FOR THE PREPARATION OF 1,3-THIAZOL-5-YLMETHYL [(2R,5R)-5-{[(2S)-2- [(METHYL{[2-(PROPAN-2-YL)- 1,3-THIAZOL-4-YL] METHYL} CARBAMOYL) AMINO] -4-(MORPHOLIN-4-YL)BUTANOYL]AMINO}-1,6-DIPHENYLHEXAN-2-YL] CARBAMATE | MSN Laboratories Private Limited (IN) | 2017-12-27 | — | — | EP | disclosed |
| WO-2016132378-A2 | NOVEL PROCESS FOR THE PREPARATION OF 1,3-THIAZOL-5-YLMETHYL [(2R,5R)-5-{[(2S)-2- [(METHYL{[2-(PROPAN-2-YL)- 1,3-THIAZOL-4-YL] METHYL} CARBAMOYL) AMINO] -4-(MORPHOLIN-4-YL)BUTANOYL]AMINO}-1,6-DIPHENYLHEXAN-2-YL] CARBAMATE | MSN LABORATORIES PRIVATE LIMITED (IN) | 2016-08-25 | — | — | 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-10351556-B2 | Process for the preparation of 1,3-thiazol-5-ylmethyl [(2R,5R)-5-{[(2s)-2-[(methyl{[2-(propan-2-yl)-1,3-thiazol-4YL] methyl} carbamoyl) amino]-4-(morpholin-4-yl)butanoyl]amino)-1,6-diphenylhexan-2-yl]carbamate | METTL3, CPS1, PKD1 | CYP3A4 810/4885CYP2D6 899/4885CYP2C9 700/4885 |
| US-20180030043-A1 | NOVEL PROCESS FOR THE PREPARATION OF 1,3-THIAZOL-5-YLMETHYL [(2R,5R)-5- CARBAMOYL) AMINO] -4-(MORPHOLIN-4-YL)BUTANOYL]AMINO}-1,6-DIPHENYLHEXAN-2-YL]CARBAMATE | CPS1, METTL3, ACMSD | CYP3A4 633/4885CYP2D6 871/4885CYP2C9 747/4885 |
“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.