Oxalic Acid

Oxalic Acid

SCHEMBL10470580

Clc1ccc2c(c1)C1CN(Cc3ccccc3)CC2O1.O.O=C(O)C(=O)O

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
ATM Q13315 2/20 0.49
DRD2 P14416 1/20 0.49
DRD3 P35462 1/20 0.49
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
DPP4 P27487 1/20 0.48
SIGMAR1 Q99720 2/20 0.47
S1PR1 P21453 2/20 0.46
S1PR5 Q9H228 2/20 0.46
KDM4E B2RXH2 6/20 0.46
ALDH1A1 P00352 4/20 0.46
HTT P42858 3/20 0.46
FAAH O00519 1/20 0.46
SMN1; SMN2 Q16637 3/20 0.45
TSHR P16473 2/20 0.45
TDP1 Q9NUW8 1/20 0.45
MAPK1 P28482 2/20 0.43
MAPT P10636 2/20 0.43
LMNA P02545 1/20 0.43
POLB P06746 1/20 0.43

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 SCHEMBL10470582 1.00 ATM (0.49) ATMDRD2DRD3MEN1KMT2A
Oxalic Acid SCHEMBL10677176 0.99 ATM (0.50) ATMDRD2DRD3MEN1KMT2A
SCHEMBL10559479 0.92 DRD2 (0.55) ATMDRD2DRD3DPP4SIGMAR1
Oxalic Acid SCHEMBL10472959 0.87 S1PR5 (0.51) ATMDRD2DRD3SIGMAR1S1PR1
Oxalic Acid SCHEMBL10471438 0.81 SLC6A12 (0.50) DRD2DRD3MEN1KMT2ASIGMAR1
Oxalic Acid SCHEMBL10472982 0.80 KDM4E (0.43) ATMDRD2DRD3MEN1KMT2A
Oxalic Acid SCHEMBL10839785 0.73 S1PR5 (0.55) ATMSIGMAR1S1PR1S1PR5KDM4E
Oxalic Acid SCHEMBL10680296 0.73 CHRNB2 (0.46)
SCHEMBL10472763 0.72 KMT2A (0.50) DRD2DRD3MEN1KMT2ASIGMAR1
SCHEMBL10471617 0.71 S1PR5 (0.47) MEN1KMT2AS1PR1S1PR5KDM4E

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-4910198-A Antiarrhythmia agent ORTHO PHARMACEUTICAL CORPORATION (US) 1990-03-20 US disclosed
US-4761413-A CYTOPROTECTION, ANTISECRETORY AGENTS ORTHO PHARMACEUTICAL CORPORATION (US) 1988-08-02 US disclosed