Oxalic Acid

Oxalic Acid

SCHEMBL9630637

Cc1ccc(Cn2c(NC3CCCN(C)CC3)nc3cccnc32)o1.O=C(O)C(=O)O.O=C(O)C(=O)O

nearest known ligand 0.42

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
OPRM1 known ✓ P35372 1/20 0.37
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
ALDH1A1 P00352 2/20 0.39
HPGD P15428 1/20 0.39
MAPT P10636 2/20 0.39
TP53 P04637 4/20 0.39
ENPP2 Q13822 2/20 0.38
RXFP1 Q9HBX9 2/20 0.38
POLB P06746 1/20 0.38
LMNA P02545 1/20 0.37
GAA P10253 1/20 0.37
OPRD1 P41143 1/20 0.37
OPRK1 P41145 1/20 0.37
SSTR4 P31391 2/20 0.36

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 SCHEMBL9630643 1.00 MEN1 (0.42) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL9687066 0.92 RET (0.39) MEN1KMT2AALDH1A1MAPTTP53
Oxalic Acid SCHEMBL9807286 0.89 ALDH1A1 (0.41) MEN1KMT2AALDH1A1HPGDMAPT
Oxalic Acid SCHEMBL9807288 0.89 ALDH1A1 (0.41) MEN1KMT2AALDH1A1HPGDMAPT
Oxalic Acid SCHEMBL9687737 0.88 MEN1 (0.42) MEN1KMT2AALDH1A1HPGDMAPT
Oxalic Acid SCHEMBL9687735 0.88 MEN1 (0.42) MEN1KMT2AALDH1A1HPGDMAPT
Oxalic Acid SCHEMBL9629530 0.87 MEN1 (0.40) MEN1KMT2AALDH1A1HPGDMAPT
Oxalic Acid SCHEMBL9629525 0.87 MEN1 (0.40) MEN1KMT2AALDH1A1HPGDMAPT
Oxalic Acid SCHEMBL9629562 0.87 TSHR (0.42) MEN1KMT2AALDH1A1HPGDMAPT
Oxalic Acid SCHEMBL9629553 0.87 TSHR (0.42) MEN1KMT2AALDH1A1HPGDMAPT

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-5151424-A Antiallergens or antihistamines JANSSEN PHARMACEUTICA N.V. (BE) 1992-09-29 US disclosed
EP-0297661-B1 [(Bicyclic heterocyclyl)methyl and -hetero] substituted hexahydro-1H-azepines and pyrrolidines JANSSEN PHARMACEUTICA N.V. (BE) 1992-09-16 EP disclosed
US-5071846-A Anti-hystaminic [(bicyclic heterocyclyl) methyl and --hetero] substituted hexahydro-1H-azepines and pyrrolidines JANSSEN PHARMACEUTICA N.V. (BE) 1991-12-10 US disclosed
US-4988689-A Antiallergens, antihistamines JANSSEN PHARMACEUTICA N.V. (BE) 1991-01-29 US disclosed