Oxalic Acid

Oxalic Acid

SCHEMBL9077832

Clc1ccc(OCCc2ccccc2)c(CCN2CCN(c3ccccn3)CC2)c1.O=C(O)C(=O)O

nearest known ligand 0.00

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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.

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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 SCHEMBL9077746 0.95 POLB (0.58) —
Oxalic Acid SCHEMBL9078292 0.91 — —
Oxalic Acid SCHEMBL9077891 0.85 SIGMAR1 (0.64) —
Oxalic Acid SCHEMBL9077172 0.85 — —
Oxalic Acid SCHEMBL9077129 0.82 KDM4E (0.58) —
Oxalic Acid SCHEMBL9076937 0.82 — —
Oxalic Acid SCHEMBL9077864 0.81 SIGMAR1 (0.74) —
Oxalic Acid SCHEMBL9075949 0.79 HTR1A (0.55) —
Hydrochloric Acid SCHEMBL9074944 0.78 SIGMAR1 (0.58) —
Hydrochloric Acid SCHEMBL9074713 0.78 SIGMAR1 (0.58) —

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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