Oxalic Acid

Oxalic Acid

SCHEMBL10800983

Cn1c(CC2CCNCC2)nc2ccccc21.Cn1c(CC2CCNCC2)nc2ccccc21.O=C(O)C(=O)O

nearest known ligand 0.52

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
HDAC6 Q9UBN7 1/20 0.52
DDB1 Q16531 1/20 0.52
CRBN Q96SW2 1/20 0.52
MAPT P10636 1/20 0.48
GRM2 Q14416 2/20 0.46
ALDH1A1 P00352 1/20 0.46
DRD2 P14416 1/20 0.46
DRD4 P21917 1/20 0.46
DRD3 P35462 1/20 0.46
RECQL P46063 1/20 0.46
LMNA P02545 1/20 0.45
KMT2A Q03164 1/20 0.45
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
KDM4E B2RXH2 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
NPY1R P25929 1/20 0.43
TSHR P16473 1/20 0.43
CYP2D6 P10635 1/20 0.42
GBA1 P04062 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 SCHEMBL10800976 1.00 HDAC6 (0.52) HDAC6DDB1CRBNMAPTGRM2
SCHEMBL9536800 0.92 DDB1 (0.55) HDAC6DDB1CRBNMAPTGRM2
Hydrochloric Acid SCHEMBL29232383 0.91 DDB1 (0.54) HDAC6DDB1CRBNMAPTGRM2
Hydrochloric Acid SCHEMBL30918533 0.91 DDB1 (0.54) HDAC6DDB1CRBNMAPTGRM2
SCHEMBL14685201 0.83 DDB1 (0.58) HDAC6DDB1CRBNMAPTGRM2
SCHEMBL8231533 0.79 LMNA (0.55) DDB1CRBNMAPTALDH1A1LMNA
SCHEMBL9537925 0.79 HTR2B (0.58) HDAC6DDB1CRBNGRM2ALDH1A1
SCHEMBL1532834 0.78 MAPT (0.54) HDAC6DDB1CRBNMAPTGRM2
SCHEMBL9537264 0.77 GBA1 (0.46) LMNANPY1RGBA1
SCHEMBL8232758 0.76 GRM2 (0.64) HDAC6DDB1CRBNMAPTGRM2

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-4695575-A ANTIHISTAMINES JANSSEN PHARMACEUTICA, N.V. (BE) 1987-09-22 US disclosed