Oxalic Acid

Oxalic Acid

SCHEMBL30067656

CC(C)(O)Cc1ccc(-c2ccc(C(=O)N3CC[C@H](N)C3)cc2-c2ccc(C#N)c(F)c2)c(F)c1.O=C(O)C(=O)O

nearest known ligand 0.95

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

OPRM1SLC6A4

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 1)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 20/20 0.95

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.

Compoundsimilaritytop predictedshared targets
SCHEMBL23496010 0.98 KDM1A (1.00) KDM1A
SCHEMBL30067548 0.98 KDM1A (1.00) KDM1A
SCHEMBL20512397 0.98 KDM1A (1.00) KDM1A
Maleic Acid SCHEMBL30067608 0.95 KDM1A (0.91) KDM1A
Fumaric Acid SCHEMBL31000952 0.95 KDM1A (0.91) KDM1A
SCHEMBL30067552 0.94 KDM1A (0.93) KDM1A
SCHEMBL30067611 0.93 KDM1A (0.91) KDM1A
SCHEMBL27171696 0.92 KDM1A (0.88) KDM1A
SCHEMBL31000932 0.92 KDM1A (0.88) KDM1A
SCHEMBL20512631 0.91 KDM1A (1.00) KDM1A

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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240228438-A1 SOLID FORMS OF SALTS OF 4-[5-[(3S)-3-AMINOPYRROLIDINE-1-CARBONYL]-2-[2-FLUORO-4-(2- HYDROXY-2-ETHYLPROPYL)PHENYL]PHENYL]-2-FLUORO-BENZONITRILE TAIHO PHARMACEUTICAL CO., LTD. (JP) 2024-07-11 US claimed
EP-4337638-A1 SOLID FORMS OF SALTS OF 4-[5-[(3S)-3-AMINOPYRROLIDINE-1-CARBONYL]-2-[2-FLUORO-4-(2-HYDROXY-2-ETHYLPROPYL)PHENYL]PHENYL]-2-FLUORO-BENZONITRILE Astex Pharmaceuticals, Inc. (US) 2024-03-20 EP claimed
WO-2022240886-A1 SOLID FORMS OF SALTS OF 4-[5-[(3S)-3-AMINOPYRROLIDINE-1-CARBONYL]-2-[2-FLUORO-4-(2-HYDROXY-2-ETHYLPROPYL)PHENYL]PHENYL]-2-FLUORO-BENZONITRILE ASTEX PHARMACEUTICALS, INC. (US) 2022-11-17 WO claimed
US-20240228438-A1 SOLID FORMS OF SALTS OF 4-[5-[(3S)-3-AMINOPYRROLIDINE-1-CARBONYL]-2-[2-FLUORO-4-(2- HYDROXY-2-ETHYLPROPYL)PHENYL]PHENYL]-2-FLUORO-BENZONITRILE TAIHO PHARMACEUTICAL CO., LTD. (JP) 2024-07-11 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 (1 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.

PatentTitleText reads most aboutPredicted target · text-rank
US-20240228438-A1 SOLID FORMS OF SALTS OF 4-[5-[(3S)-3-AMINOPYRROLIDINE-1-CARBONYL]-2-[2-FLUORO-4-(2- HYDROXY-2-ETHYLPROPYL)PHENYL]PHENYL]-2-FLUORO-BENZONITRILE AFF4, SKP1, CYP3A4 KDM1A 286/4885

“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.