Oxalic Acid

Oxalic Acid

SCHEMBL9075024

COc1cccc(CCN2CCCC2)c1OCCc1ccccc1.O=C(O)C(=O)O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

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 9)

geneUniProtsupporting neighboursconfidence
▸ SIGMAR1 Q99720 3/20 0.66
▸ SCN9A Q15858 1/20 0.58
▸ HRH3 Q9Y5N1 1/20 0.56
▸ MEN1 O00255 1/20 0.56
▸ KMT2A Q03164 1/20 0.56
▸ POLB P06746 1/20 0.55
▸ KDM4E B2RXH2 2/20 0.55
▸ ALDH1A1 P00352 2/20 0.55
▸ LMNA P02545 1/20 0.55

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
Oxalic Acid SCHEMBL9077392 0.91 KDM4E (0.58) SIGMAR1MEN1KMT2AKDM4EALDH1A1
Oxalic Acid SCHEMBL9077245 0.90 MEN1 (0.57) SIGMAR1MEN1KMT2AKDM4EALDH1A1
Oxalic Acid SCHEMBL9075949 0.85 HTR1A (0.55) MEN1KMT2APOLBKDM4EALDH1A1
Oxalic Acid SCHEMBL9077499 0.79 SIGMAR1 (1.00) SIGMAR1
SCHEMBL9076740 0.79 HPGD (0.53) SCN9A
SCHEMBL8733917 0.78 SCN9A (0.53) SCN9A
Oxalic Acid SCHEMBL8728762 0.77 BCHE (0.61) —
SCHEMBL11569134 0.76 ALDH1A1 (0.63) SIGMAR1SCN9AMEN1KMT2AKDM4E
Oxalic Acid SCHEMBL8198057 0.75 BCHE (0.64) —
SCHEMBL14970725 0.75 POLB (0.76) HRH3MEN1KMT2APOLBKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5495046-A PSYCHOLOGICAL DISORDERS TAISHO PHARMACEUTICAL CO., LTD. (JP) 1996-02-27 — — US disclosed
EP-0641766-A1 ALKOXYPHENYLALKYLAMINE DERIVATIVE TAISHO PHARMACEUTICAL CO. LTD (JP) 1995-03-08 — — EP disclosed
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