Oxalic Acid

Oxalic Acid

SCHEMBL4608690

C[C@H](Nc1nccc(Nc2ccc(F)cc2)n1)C(C)(C)O.O=C(O)C(=O)O

nearest known ligand 0.56

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 20)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 8/20 0.56
MEN1 O00255 1/20 0.54
NPC1 O15118 1/20 0.54
LMNA P02545 1/20 0.54
MAPT P10636 1/20 0.54
ALOX12 P18054 1/20 0.54
MAPK1 P28482 1/20 0.54
RAB9A P51151 1/20 0.54
KMT2A Q03164 1/20 0.54
MAPK8 P45983 1/20 0.49
MAPK14 Q16539 4/20 0.48
AURKA O14965 5/20 0.47
MAPK13 O15264 2/20 0.46
MAPK12 P53778 2/20 0.46
MAPK11 Q15759 2/20 0.46
AURKB Q96GD4 1/20 0.44
USP2 O75604 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2C19 P33261 1/20 0.44

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
SCHEMBL14009478 0.94 MEN1 (0.61) PLK1MEN1NPC1LMNAMAPT
SCHEMBL4828825 0.80 MAPK1 (0.65) PLK1MEN1NPC1LMNAMAPT
SCHEMBL14110210 0.79 MAPK1 (0.71) PLK1MEN1NPC1LMNAMAPT
SCHEMBL31079006 0.77 NPC1 (0.64) PLK1MEN1NPC1LMNAMAPT
SCHEMBL4839139 0.73 MAPK14 (0.76) PLK1MAPK14MAPK13MAPK12MAPK11
SCHEMBL4839149 0.73 MAPK14 (0.76) PLK1MAPK14MAPK13MAPK12MAPK11
SCHEMBL3300205 0.73 AURKA (0.86) MEN1NPC1LMNAMAPTALOX12
SCHEMBL1926360 0.72 PLK1 (1.00) PLK1MAPK1MAPK8AURKAMAPK12
SCHEMBL1926363 0.72 PLK1 (1.00) PLK1MAPK1MAPK8AURKAMAPK12
SCHEMBL4608984 0.72 MAPK14 (0.72) PLK1MAPK14MAPK13MAPK12MAPK11

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7449474-B2 Tri-substituted ureas as cytokine inhibitors THE PROCTER & GAMBLE COMPANY (US) 2008-11-11 US disclosed
EP-1747204-B1 TRI-SUBSTITUTED UREAS AS CYTOKINE INHIBITORS PROCTER & GAMBLE (US) 2008-07-30 EP disclosed
EP-1747204-A1 TRI-SUBSTITUTED UREAS AS CYTOKINE INHIBITORS The Procter and Gamble Company (US) 2007-01-31 EP disclosed
WO-2005105758-A1 TRI-SUBSTITUTED UREAS AS CYTOKINE INHIBITORS THE PROCTER & GAMBLE COMPANY (US) 2005-11-10 WO disclosed
US-20050239811-A1 Tri-substituted ureas as cytokine inhibitors THE PROCTER & GAMBLE COMPANY (US) 2005-10-27 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-20050239811-A1 Tri-substituted ureas as cytokine inhibitors IL1B, IL1A, IL6 PLK1 3980/4885MEN1 3574/4885NPC1 3402/4885

“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.