Oxalic Acid

Oxalic Acid

SCHEMBL9538445

CCOCCn1c(NC2CCN(CCOc3ncccn3)CC2)nc2cccnc21.O=C(O)C(=O)O.O=C(O)C(=O)O

nearest known ligand 0.44

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 12)

geneUniProtsupporting neighboursconfidence
OPRM1 known ✓ P35372 2/20 0.40
HRH1 P35367 8/20 0.44
SLC6A9 P48067 1/20 0.43
MAPT P10636 2/20 0.41
OPRD1 P41143 2/20 0.40
OPRK1 P41145 2/20 0.40
HRH2 P25021 3/20 0.39
KDM4E B2RXH2 2/20 0.38
HTR2A P28223 1/20 0.38
HTR2C P28335 1/20 0.38
HTR2B P41595 1/20 0.38
KCNH2 Q12809 3/20 0.37

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 SCHEMBL9538448 1.00 HRH1 (0.44) HRH1SLC6A9MAPTOPRM1OPRD1
Oxalic Acid SCHEMBL9539822 0.96 HRH1 (0.47) HRH1SLC6A9MAPTOPRM1OPRD1
Oxalic Acid SCHEMBL9539814 0.96 HRH1 (0.47) HRH1SLC6A9MAPTOPRM1OPRD1
Oxalic Acid SCHEMBL10383155 0.88 SLC6A9 (0.41) HRH1SLC6A9MAPTOPRM1OPRD1
SCHEMBL9535303 0.88 SLC6A9 (0.44) HRH1SLC6A9MAPTOPRM1OPRD1
Oxalic Acid SCHEMBL9535612 0.87 HRH1 (0.46) HRH1SLC6A9MAPTOPRM1OPRD1
Oxalic Acid SCHEMBL9536954 0.87 SLC6A9 (0.41) HRH1SLC6A9MAPTOPRM1OPRD1
Oxalic Acid SCHEMBL9536963 0.87 SLC6A9 (0.41) HRH1SLC6A9MAPTOPRM1OPRD1
Oxalic Acid SCHEMBL9535618 0.87 HRH1 (0.46) HRH1SLC6A9MAPTOPRM1OPRD1
SCHEMBL9535360 0.87 HRH1 (0.54) HRH1SLC6A9MAPTOPRM1OPRD1

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
EP-0282133-B1 1-ALKYL SUBSTITUTED BENZIMIDAZOLE DERIVATIVES JANSSEN PHARMACEUTICA N.V. (BE) 1993-07-28 EP disclosed
US-4943580-A ANTIALLERGENS JANSSEN PHARMACEUTICA N.V. (BE) 1990-07-24 US disclosed