Oxalic Acid

Oxalic Acid

SCHEMBL11859605

CCCCCCOc1ccccc1OCC(O)CN(C)CCn1cnc2c1c(=O)n(CC)c(=O)n2CC.O=C(O)C(=O)O

nearest known ligand 0.43

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 13)

geneUniProtsupporting neighboursconfidence
▸ CNOT7 Q9UIV1 7/20 0.43
▸ PARN O95453 1/20 0.41
▸ RXFP1 Q9HBX9 1/20 0.41
▸ PDE4A P27815 2/20 0.40
▸ PDE4B Q07343 2/20 0.40
▸ PDE4C Q08493 2/20 0.40
▸ PDE4D Q08499 2/20 0.40
▸ ADORA2A P29274 2/20 0.40
▸ ADORA2B P29275 1/20 0.40
▸ KMT2A Q03164 3/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ ABCB1 P08183 2/20 0.39
▸ LMNA P02545 1/20 0.38

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
SCHEMBL11859607 0.88 CNOT7 (0.41) CNOT7PARNRXFP1PDE4APDE4B
SCHEMBL11855033 0.88 CNOT7 (0.48) CNOT7PARNRXFP1PDE4APDE4B
Hydrochloric Acid SCHEMBL11852871 0.87 CNOT7 (0.47) CNOT7PARNRXFP1PDE4APDE4B
Hydrochloric Acid SCHEMBL11851840 0.80 CNOT7 (0.48) CNOT7PARNRXFP1PDE4APDE4B
Hydrochloric Acid SCHEMBL11846176 0.79 CNOT7 (0.47) CNOT7PARNRXFP1KMT2AMEN1
Hydrochloric Acid SCHEMBL11852085 0.79 CNOT7 (0.46) CNOT7PARNRXFP1KMT2AMEN1
Hydrochloric Acid SCHEMBL11850656 0.78 ADORA1 (0.46) CNOT7RXFP1PDE4APDE4BPDE4C
SCHEMBL11843030 0.76 CNOT7 (0.44) CNOT7PARNRXFP1KMT2AMEN1
Cadaverine Tartrate SCHEMBL11848587 0.76 KMT2A (0.46) CNOT7RXFP1KMT2AMEN1
Hydrochloric Acid SCHEMBL11849779 0.74 RXFP1 (0.54) CNOT7RXFP1ADORA2BLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-3998953-A 1,3,7-Trisubstitued xanthine peripheral vasodilators BOEHRINGER INGELHEIM GMBH (DT) 1976-12-21 — — US disclosed
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