Oxalic Acid

Oxalic Acid

SCHEMBL9534482

O=C(O)C(=O)O.O=C(O)C(=O)O.O=C(O)C(=O)O.O=C(O)CNCCn1c(NC2CCN(Cc3ccccc3)CC2)nc2cccnc21

nearest known ligand 0.49

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 20)

geneUniProtsupporting neighboursconfidence
SSTR5 P35346 2/20 0.49
LMNA P02545 4/20 0.45
DRD2 P14416 2/20 0.44
DRD4 P21917 2/20 0.44
DRD3 P35462 2/20 0.44
SIGMAR1 Q99720 2/20 0.43
TP53 P04637 1/20 0.43
ALDH1A1 P00352 1/20 0.43
HPGD P15428 1/20 0.43
ENPP2 Q13822 3/20 0.43
MAPT P10636 2/20 0.43
NTSR1 P30989 1/20 0.43
HTT P42858 1/20 0.43
KMT2A Q03164 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
GBA1 P04062 1/20 0.43
POLB P06746 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
RXFP1 Q9HBX9 1/20 0.42
GAA P10253 1/20 0.42

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 SCHEMBL10383157 0.97 SSTR5 (0.47) SSTR5LMNADRD2DRD4DRD3
Oxalic Acid SCHEMBL10383159 0.90 ALDH1A1 (0.49) SSTR5LMNADRD2DRD4DRD3
Oxalic Acid SCHEMBL10383158 0.90 ALDH1A1 (0.49) SSTR5LMNADRD2DRD4DRD3
SCHEMBL9539259 0.88 SSTR5 (0.52) SSTR5LMNADRD2DRD4DRD3
SCHEMBL9536516 0.87 SSTR5 (0.52) SSTR5LMNADRD2DRD4DRD3
Hydrochloric Acid SCHEMBL9538066 0.86 SSTR5 (0.52) SSTR5LMNADRD2DRD4DRD3
SCHEMBL9537229 0.84 SSTR5 (0.56) SSTR5LMNADRD2DRD4DRD3
SCHEMBL9538214 0.83 NR4A2 (0.42) LMNATP53ALDH1A1HPGDENPP2
SCHEMBL9535999 0.82 SSTR5 (0.56) SSTR5LMNADRD2DRD4DRD3
Hydrochloric Acid SCHEMBL9536739 0.82 NR4A2 (0.41) LMNATP53ALDH1A1HPGDENPP2

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
EP-0282133-B1 1-ALKYL SUBSTITUTED BENZIMIDAZOLE DERIVATIVES JANSSEN PHARMACEUTICA N.V. (BE) 1993-07-28 EP disclosed
EP-0282133-A2 1-alkyl substituted benzimidazole derivatives JANSSEN PHARMACEUTICA N.V. (BE) 1988-09-14 EP disclosed