Oxalic Acid

Oxalic Acid

SCHEMBL3824009

NC(=O)c1ccc(OCCCN2C[C@H]3C[C@H]3C2)cc1.O=C(O)C(=O)O

nearest known ligand 0.75

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 19)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 2/20 0.75
KDM4E B2RXH2 12/20 0.52
PARP10 Q53GL7 1/20 0.51
ALDH1A1 P00352 6/20 0.51
KMT2A Q03164 2/20 0.51
HTT P42858 2/20 0.51
MEN1 O00255 1/20 0.51
HRH2 P25021 1/20 0.49
HRH1 P35367 1/20 0.49
SMN1; SMN2 Q16637 3/20 0.49
TDP1 Q9NUW8 2/20 0.48
POLB P06746 1/20 0.48
MAPT P10636 1/20 0.48
ESRRB O95718 2/20 0.47
ESR1 P03372 2/20 0.47
ESRRG P62508 2/20 0.47
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
MAOB P27338 1/20 0.46

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
SCHEMBL4292974 0.96 HRH3 (0.81) HRH3KDM4EPARP10HRH2HRH1
SCHEMBL3828655 0.96 HRH3 (0.81) HRH3KDM4EPARP10HRH2HRH1
Hydrochloric Acid SCHEMBL3828271 0.95 HRH3 (0.79) HRH3KDM4EPARP10HRH2HRH1
Oxalic Acid SCHEMBL1976615 0.92 HRH3 (0.83) HRH3KDM4EPARP10ALDH1A1KMT2A
SCHEMBL3828820 0.92 HRH3 (0.74) HRH3KDM4EPARP10ALDH1A1KMT2A
Oxalic Acid SCHEMBL14150312 0.90 HRH3 (0.93) HRH3KDM4EPARP10ALDH1A1KMT2A
Oxalic Acid SCHEMBL4494998 0.90 HRH3 (0.93) HRH3KDM4EPARP10ALDH1A1KMT2A
SCHEMBL3827146 0.89 HRH3 (0.70) HRH3KDM4EPARP10HRH2HRH1
SCHEMBL1977578 0.88 HRH3 (0.90) HRH3PARP10HRH2HRH1MAOB
Hydrochloric Acid SCHEMBL1979057 0.87 HRH3 (0.88) HRH3PARP10HRH2HRH1MAOB

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-7906547-B2 Azabicylic compounds, a process for their preparation and pharmaceutical compositions containing them LES LABORATOIRES SERVIER (FR) 2011-03-15 US claimed
US-20090312389-A1 Azabicylic compounds, a process for their preparation and pharmaceutical compositions containing them LES LABORATOIRES SERVIER (FR) 2009-12-17 US claimed
US-7906547-B2 Azabicylic compounds, a process for their preparation and pharmaceutical compositions containing them LES LABORATOIRES SERVIER (FR) 2011-03-15 US disclosed
US-20090312389-A1 Azabicylic compounds, a process for their preparation and pharmaceutical compositions containing them LES LABORATOIRES SERVIER (FR) 2009-12-17 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-20090312389-A1 Azabicylic compounds, a process for their preparation and pharmaceutical compositions containing them CHAT, MAOB, ALKBH2 HRH3 2086/4885KDM4E 286/4885PARP10 1347/4885

“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.