Oxalic Acid

Oxalic Acid

SCHEMBL4054

CN(C)CCC(Oc1ccc(C(F)(F)F)cc1)C1CCCCC1.O=C(O)C(=O)O

nearest known ligand 0.50

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 9)

geneUniProtsupporting neighboursconfidence
SLC6A4 known ✓ P31645 4/20 0.50
HRH3 Q9Y5N1 4/20 0.50
SLC6A9 P48067 8/20 0.45
KDM4E B2RXH2 2/20 0.45
MEN1 O00255 1/20 0.44
MITF O75030 1/20 0.44
KMT2A Q03164 1/20 0.44
SLC6A5 Q9Y345 1/20 0.40
UTS2R Q9UKP6 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
Hydrochloric Acid SCHEMBL3937 0.92 SLC6A4 (0.52) SLC6A4HRH3SLC6A9MEN1KMT2A
SCHEMBL10989251 0.87 SLC6A4 (0.56) SLC6A4HRH3SLC6A9KDM4EMEN1
Oxalic Acid SCHEMBL3500 0.84 MEN1 (0.50) SLC6A4HRH3KDM4EMEN1MITF
SCHEMBL5143084 0.77 SLC6A2 (0.50) SLC6A4MEN1MITFKMT2A
SCHEMBL4055 0.77 NPC1 (0.38) SLC6A4SLC6A9
SCHEMBL10996291 0.75 SLC6A9 (0.44) SLC6A4HRH3SLC6A9KDM4EUTS2R
Oxalic Acid SCHEMBL7317614 0.74 SLC6A4 (0.88) SLC6A4HRH3SLC6A9KDM4EMEN1
Oxalic Acid SCHEMBL4740319 0.73 SLC6A4 (0.72) SLC6A4HRH3SLC6A9SLC6A5UTS2R
SCHEMBL10989062 0.73 SLC6A4 (0.44) SLC6A4HRH3KDM4EMEN1KMT2A
SCHEMBL10984411 0.73 SLC6A4 (0.43) SLC6A4HRH3KDM4E

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
US-5023269-A 3-aryloxy-3-substituted propanamines ELI LILLY AND COMPANY (US) 1991-06-11 US disclosed
EP-0273658-B1 3-ARYLOXY-3-SUBSTITUTED PROPANAMINES ELI LILLY AND COMPANY (US) 1990-10-31 EP disclosed
US-4956388-A ANTIDEPRESSANTS, ANTIANXIETY, TREATMENT OF OBESITY, ADDICTION TO SMOKING AND ALCOHOL ELI LILLY AND COMPANY (US) 1990-09-11 US disclosed
EP-0273658-A1 3-Aryloxy-3-substituted propanamines ELI LILLY AND COMPANY (US) 1988-07-06 EP disclosed