Oxalic Acid

Oxalic Acid

SCHEMBL9634849

CCOCCn1c(CN2CCN(CCNc3ncccn3)CC2)nc2cccnc21.O=C(O)C(=O)O.O=C(O)C(=O)O

nearest known ligand 0.61

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 15)

geneUniProtsupporting neighboursconfidence
SLC6A9 P48067 1/20 0.61
CHRM5 P08912 1/20 0.44
CHRM1 P11229 1/20 0.44
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
TP53 P04637 3/20 0.40
RXFP1 Q9HBX9 1/20 0.39
GAA P10253 1/20 0.39
ENPP2 Q13822 1/20 0.39
KDM4E B2RXH2 3/20 0.39
ALDH1A1 P00352 2/20 0.39
TDP1 Q9NUW8 1/20 0.39
LMNA P02545 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
MAPT P10636 1/20 0.38

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 SCHEMBL9634855 1.00 SLC6A9 (0.61) SLC6A9CHRM5CHRM1MEN1KMT2A
Oxalic Acid SCHEMBL9636339 0.88 SLC6A9 (0.56) SLC6A9CHRM5CHRM1MEN1KMT2A
Oxalic Acid SCHEMBL9535399 0.88 SLC6A9 (0.47) SLC6A9MEN1KMT2ATP53KDM4E
Oxalic Acid SCHEMBL9535391 0.88 SLC6A9 (0.47) SLC6A9MEN1KMT2ATP53KDM4E
Oxalic Acid SCHEMBL9634587 0.88 SLC6A9 (0.65) SLC6A9CHRM5CHRM1MEN1KMT2A
Oxalic Acid SCHEMBL9634559 0.88 SLC6A9 (0.59) SLC6A9CHRM5CHRM1MEN1KMT2A
Oxalic Acid SCHEMBL9634553 0.88 SLC6A9 (0.59) SLC6A9CHRM5CHRM1MEN1KMT2A
Oxalic Acid SCHEMBL9870147 0.86 SLC6A9 (0.66) SLC6A9CHRM5CHRM1MEN1KMT2A
Oxalic Acid SCHEMBL9870156 0.86 SLC6A9 (0.66) SLC6A9CHRM5CHRM1MEN1KMT2A
Oxalic Acid SCHEMBL9636381 0.86 SLC6A9 (0.57) SLC6A9CHRM5CHRM1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0307014-B1 ANTI-ALLERGIC 2-(HETEROCYCLYL ALKYL) IMIDAZO PYRIDINES AND 2-(HETEROCYCLYL ALKYL) PURINES JANSSEN PHARMACEUTICA N.V. (BE) 1992-12-09 EP disclosed
US-5086056-A Treating allergic diseases JANSSEN PHARMACEUTICA N.V. (BE) 1992-02-04 US disclosed
US-5011842-A Antihistamines JANSSEN PHARMACEUTICA N.V. (BE) 1991-04-30 US disclosed
US-4946843-A ANTIALLERGENS JANSSEN PHARMACEUTICA N.V. (BE) 1990-08-07 US disclosed
EP-0307014-A1 Anti-allergic 2-(heterocyclyl alkyl) imidazo pyridines and 2-(heterocyclyl alkyl) purines JANSSEN PHARMACEUTICA N.V. (BE) 1989-03-15 EP disclosed