Oxalic Acid

Oxalic Acid

SCHEMBL9630286

COc1ccc(CCN2CCC(Nc3nc4ccccc4n3Cc3cnccn3)C2)cc1.O=C(O)C(=O)O.O=C(O)C(=O)O

nearest known ligand 0.67

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 20)

geneUniProtsupporting neighboursconfidence
SLC6A4 known ✓ P31645 1/20 0.61
OPRM1 known ✓ P35372 1/20 0.61
EED O75530 2/20 0.67
KCNH2 Q12809 14/20 0.61
SSTR5 P35346 3/20 0.61
LMNA P02545 2/20 0.61
GAA P10253 2/20 0.61
TACR2 P21452 2/20 0.61
TACR1 P25103 2/20 0.61
HRH1 P35367 2/20 0.61
MEN1 O00255 1/20 0.61
MLNR O43193 1/20 0.61
CACNA1F O60840 1/20 0.61
USP2 O75604 1/20 0.61
ABCB11 O95342 1/20 0.61
EGFR P00533 1/20 0.61
HLA-A P04439 1/20 0.61
ERBB2 P04626 1/20 0.61
TP53 P04637 1/20 0.61
CYP1A2 P05177 1/20 0.61

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 SCHEMBL9630290 1.00 EED (0.67) EEDKCNH2SSTR5LMNAGAA
SCHEMBL1152441 0.92 KCNH2 (0.72) EEDKCNH2SSTR5LMNAGAA
Oxalic Acid SCHEMBL9630103 0.87 EED (0.67) EEDKCNH2SSTR5LMNAGAA
Oxalic Acid SCHEMBL9630097 0.87 EED (0.67) EEDKCNH2SSTR5LMNAGAA
Oxalic Acid SCHEMBL9630570 0.83 EED (0.68) EEDKCNH2SSTR5LMNAGAA
Oxalic Acid SCHEMBL9630564 0.83 EED (0.68) EEDKCNH2SSTR5LMNAGAA
SCHEMBL9631586 0.81 KCNH2 (0.50) EEDKCNH2SSTR5LMNAGAA
SCHEMBL9629272 0.80 EED (1.00) EEDKCNH2SSTR5LMNAGAA
SCHEMBL12045363 0.80 KCNH2 (0.88) EEDKCNH2SSTR5LMNAGAA
Fumaric Acid SCHEMBL10551708 0.79 HRH1 (0.49) EEDKCNH2SSTR5LMNAGAA

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 2 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
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