Oxalic Acid

Oxalic Acid

SCHEMBL27398516

Cc1ccc2c(c1)CC(=O)N2CCN1CCN(Cc2ccc(F)cc2)CC1.O=C(O)C(=O)O.O=C(O)C(=O)O

nearest known ligand 0.52

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 8)

geneUniProtsupporting neighboursconfidence
▸ DRD2 P14416 2/20 0.52
▸ DRD4 P21917 2/20 0.52
▸ KDM4E B2RXH2 3/20 0.46
▸ ALDH1A1 P00352 3/20 0.46
▸ KMT2A Q03164 3/20 0.46
▸ MEN1 O00255 2/20 0.46
▸ MAPK1 P28482 1/20 0.46
▸ ATM Q13315 1/20 0.43

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
SCHEMBL9096207 0.95 DRD4 (0.57) DRD2DRD4
SCHEMBL9095908 0.86 DRD2 (0.62) DRD2DRD4KDM4EALDH1A1KMT2A
Oxalic Acid SCHEMBL27377361 0.85 DRD2 (0.71) DRD2DRD4KMT2AMEN1ATM
Hydrochloric Acid SCHEMBL9095647 0.85 DRD4 (0.60) DRD2DRD4
Hydrochloric Acid SCHEMBL9095767 0.83 DRD4 (0.56) DRD2DRD4ALDH1A1
SCHEMBL9096134 0.82 DRD2 (0.62) DRD2DRD4
SCHEMBL9096608 0.79 DRD2 (0.80) DRD2DRD4KMT2AMEN1
SCHEMBL9382409 0.78 DRD2 (0.49) DRD2DRD4KDM4EALDH1A1KMT2A
SCHEMBL9096623 0.77 DRD4 (0.51) DRD2DRD4KMT2AMEN1
SCHEMBL9094905 0.76 DRD4 (0.64) DRD2DRD4KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1079464-A Treatment comprises the preparation method of the valuable indolone of illness of cholinergic function reduction and the derivative of indole dione ASTRA AB (SE) 1993-12-15 — — CN disclosed
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