Oxalic Acid

Oxalic Acid

SCHEMBL9636294

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

nearest known ligand 0.63

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 16)

geneUniProtsupporting neighboursconfidence
SLC6A9 P48067 1/20 0.63
GPR4 P46093 1/20 0.48
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
CHRM5 P08912 1/20 0.46
CHRM1 P11229 1/20 0.46
TP53 P04637 3/20 0.42
RXFP1 Q9HBX9 1/20 0.41
ENPP2 Q13822 2/20 0.41
ALDH1A1 P00352 2/20 0.40
LMNA P02545 3/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
KDM4E B2RXH2 1/20 0.39
TACR2 P21452 1/20 0.39
TSHR P16473 1/20 0.39
MAPT P10636 1/20 0.39

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 SCHEMBL9636289 1.00 SLC6A9 (0.63) SLC6A9GPR4MEN1KMT2ACHRM5
Oxalic Acid SCHEMBL9634587 0.89 SLC6A9 (0.65) SLC6A9MEN1KMT2ACHRM5CHRM1
Oxalic Acid SCHEMBL9870147 0.87 SLC6A9 (0.66) SLC6A9MEN1KMT2ACHRM5CHRM1
Oxalic Acid SCHEMBL9870156 0.87 SLC6A9 (0.66) SLC6A9MEN1KMT2ACHRM5CHRM1
Oxalic Acid SCHEMBL9636284 0.87 SLC6A9 (0.61) SLC6A9MEN1KMT2ACHRM5CHRM1
Oxalic Acid SCHEMBL9636291 0.86 SLC6A9 (0.60) SLC6A9MEN1KMT2ACHRM5CHRM1
Oxalic Acid SCHEMBL9636288 0.86 SLC6A9 (0.60) SLC6A9MEN1KMT2ACHRM5CHRM1
Oxalic Acid SCHEMBL9634632 0.86 SLC6A9 (0.60) SLC6A9MEN1KMT2ACHRM5CHRM1
Oxalic Acid SCHEMBL9634639 0.86 SLC6A9 (0.60) SLC6A9MEN1KMT2ACHRM5CHRM1
Hydrochloric Acid SCHEMBL9636312 0.86 SLC6A9 (0.64) SLC6A9MEN1KMT2ACHRM5CHRM1

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-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