Oxalic Acid

Oxalic Acid

SCHEMBL7327873

Fc1ccc(OCCC2CCN(CC=Cc3ccccc3)CC2)cc1.O=C(O)C(=O)O

nearest known ligand 0.65

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
SLC6A4 known ✓ P31645 1/20 0.65
SLC6A3 Q01959 1/20 0.65
S1PR1 P21453 1/20 0.56
KDM4E B2RXH2 1/20 0.56
HRH3 Q9Y5N1 1/20 0.55
CCR3 P51677 1/20 0.53
LMNA P02545 2/20 0.50
GAA P10253 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
PLA2G1B P04054 1/20 0.49
ATG4B Q9Y4P1 1/20 0.49

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 SCHEMBL7327867 1.00 SLC6A4 (0.65) SLC6A4SLC6A3S1PR1KDM4EHRH3
SCHEMBL7326600 0.95 SLC6A4 (0.71) SLC6A4SLC6A3S1PR1KDM4EHRH3
SCHEMBL7326607 0.95 SLC6A4 (0.71) SLC6A4SLC6A3S1PR1KDM4EHRH3
Oxalic Acid SCHEMBL7320957 0.85 S1PR1 (0.51) SLC6A4SLC6A3S1PR1KDM4EHRH3
Oxalic Acid SCHEMBL7320960 0.85 S1PR1 (0.51) SLC6A4SLC6A3S1PR1KDM4EHRH3
Oxalic Acid SCHEMBL7245307 0.81 MCHR1 (0.49) SLC6A4SLC6A3S1PR1KDM4EHRH3
Oxalic Acid SCHEMBL7245310 0.81 MCHR1 (0.49) SLC6A4SLC6A3S1PR1KDM4EHRH3
Oxalic Acid SCHEMBL9530845 0.80 ALDH1A1 (0.52) SLC6A4SLC6A3KDM4EHRH3CCR3
Oxalic Acid SCHEMBL9530842 0.80 ALDH1A1 (0.52) SLC6A4SLC6A3KDM4EHRH3CCR3
Oxalic Acid SCHEMBL7326226 0.80 DRD2 (0.54) SLC6A4SLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0559700-A1 NOVEL PILOCARPINE DERIVATIVES AND PROCESS FOR THEIR PREPARATION Santen Oy (FI) 1993-09-15 EP disclosed
CN-1061963-A Be used as the croak pyridine class of the 4-replacement of medicine SMITH KLINE FRENCH LAB (GB) 1992-06-17 CN disclosed
WO-1992009583-A1 NOVEL PILOCARPINE DERIVATIVES AND PROCESS FOR THEIR PREPARATION LEIRAS OY (FI) 1992-06-11 WO disclosed
WO-1992002502-A1 N-HYDROCARBYL-4-SUBSTITUTED PIPERIDINES, THEIR PREPARATION AND USE AS CALCIUM BLOCKING AGENTS SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1992-02-20 WO disclosed