Oxalic Acid

Oxalic Acid

SCHEMBL3813189

COc1ccc(CN(C)CCOCCc2ccc3sccc3c2)cc1.O=C(O)C(=O)O

nearest known ligand 0.47

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 8)

geneUniProtsupporting neighboursconfidence
▸ SIGMAR1 Q99720 2/20 0.44
▸ KDM4E B2RXH2 1/20 0.43
▸ ACHE P22303 3/20 0.43
▸ ATM Q13315 1/20 0.43
▸ TSHR P16473 1/20 0.42
▸ MEN1 O00255 2/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ BCHE P06276 1/20 0.40

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
SCHEMBL3817518 0.94 SIGMAR1 (0.45) SIGMAR1KDM4EACHETSHRBCHE
Oxalic Acid SCHEMBL3813466 0.91 KDM4E (0.48) SIGMAR1KDM4EATMMEN1KMT2A
Oxalic Acid SCHEMBL3811672 0.89 SIGMAR1 (0.45) SIGMAR1KDM4EATM
Oxalic Acid SCHEMBL3813644 0.85 ACHE (0.48) SIGMAR1KDM4EACHEATMMEN1
Oxalic Acid SCHEMBL3813198 0.85 SIGMAR1 (0.48) SIGMAR1KDM4E
SCHEMBL3812050 0.85 SIGMAR1 (0.47) SIGMAR1KDM4EACHEATMTSHR
Oxalic Acid SCHEMBL3807582 0.84 SIGMAR1 (0.48) SIGMAR1KDM4EMEN1KMT2A
Oxalic Acid SCHEMBL3808414 0.82 SIGMAR1 (0.48) SIGMAR1KDM4E
SCHEMBL3812877 0.82 SIGMAR1 (0.46) SIGMAR1KDM4ETSHR
Oxalic Acid SCHEMBL3812194 0.82 SIGMAR1 (0.46) SIGMAR1KDM4EMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1186594-B1 N-ALKOXYALKYL-N,N-DIALKYLAMINE DERIVATIVES OR SALTS THEREOF, AND REMEDIES FOR NERVE DEGENERATION DISEASES CONTAINING THE SAME TOYAMA CHEMICAL CO LTD (JP) 2009-08-05 — — EP disclosed
US-6797726-B1 N-alkoxyalkyl-N,N-dialkylamine derivatives or salts thereof, and remedies for nerve degeneration diseases containing the same TOYAMA CHEMICAL CO., LTD. (JP) 2004-09-28 — — US disclosed
EP-1186594-A1 N-ALKOXYALKYL-N,N-DIALKYLAMINE DERIVATIVES OR SALTS THEREOF, AND REMEDIES FOR NERVE DEGENERATION DISEASES CONTAINING THE SAME TOYAMA CHEMICAL CO., LTD. (JP) 2002-03-13 — — EP disclosed
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