Maleic Acid

Maleic Acid

SCHEMBL9506523

CCCN(CCOc1ccccc1OC)CCc1ccc(OC(=O)C(C)C)c(OC(=O)C(C)C)c1.O=C(O)/C=C\C(=O)O

nearest known ligand 0.59

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Known targets — ChEMBL curated mechanism

ACEADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2BTKCACNA1CCACNA1DCACNA1FCACNA1SCCR5CPT1BCPT2DPP4DRD1DRD2EGFRERBB2ERBB4HRH1HRH3HTR1AHTR2AHTR2BHTR2CHTR4JAK1JAK2JAK3MPLMTORPPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PPARGSLC6A2SLC6A3SLC6A4SMOTYK2pol

The experimentally established mechanism targets of Maleic Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 2/20 0.56
EBP Q15125 1/20 0.56
TMEM97 Q5BJF2 1/20 0.56

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
SCHEMBL9504591 0.94 SIGMAR1 (0.59) SIGMAR1EBPTMEM97
Fumaric Acid SCHEMBL9506530 0.76 SIGMAR1 (0.35) SIGMAR1EBPTMEM97
SCHEMBL9503522 0.75 SIGMAR1 (0.52) SIGMAR1EBPTMEM97
Oxalic Acid SCHEMBL8728738 0.74 SIGMAR1 (0.89) SIGMAR1EBPTMEM97
Oxalic Acid SCHEMBL8201207 0.74 SIGMAR1 (0.80) SIGMAR1EBPTMEM97
SCHEMBL9504487 0.74 ADRA1D (0.74) SIGMAR1EBPTMEM97
Oxalic Acid SCHEMBL8198623 0.74 SIGMAR1 (0.79) SIGMAR1EBPTMEM97
Hydrochloric Acid SCHEMBL9505511 0.73 ADRA1D (0.73) SIGMAR1EBPTMEM97
Oxalic Acid SCHEMBL9077112 0.73 SIGMAR1 (0.78) SIGMAR1EBPTMEM97
SCHEMBL3228699 0.73 SIGMAR1 (1.00) SIGMAR1EBPTMEM97

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-0321967-B1 COMPOUNDS ACTIVE ON THE CARDIOVASCULAR SYSTEM ZAMBON GROUP S.p.A. (IT) 1993-07-28 EP disclosed
EP-0321967-A2 Compounds active on the cardiovascular system ZAMBON GROUP S.p.A. (IT) 1989-06-28 EP disclosed