Maleic Acid

Maleic Acid

SCHEMBL2889020

CC1(C)Oc2cc(NS(C)(=O)=O)ccc2[C@H](NCCc2ccccc2)[C@H]1O.O=C(O)/C=C\C(=O)O

nearest known ligand 0.44

Full drug profile on Sugi Atlas →

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 6)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 10/20 0.44
ABCB1 P08183 3/20 0.39
OPRM1 P35372 1/20 0.38
IDO1 P14902 1/20 0.37
ALDH1A1 P00352 1/20 0.36
TAAR1 Q96RJ0 1/20 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
Maleic Acid SCHEMBL2889017 1.00 KCNA5 (0.44) KCNA5ABCB1OPRM1IDO1ALDH1A1
Fumaric Acid SCHEMBL2889022 1.00 KCNA5 (0.44) KCNA5ABCB1OPRM1IDO1ALDH1A1
SCHEMBL2889459 0.94 KCNA5 (0.47) KCNA5ABCB1OPRM1IDO1
SCHEMBL2889456 0.94 KCNA5 (0.47) KCNA5ABCB1OPRM1IDO1
Fumaric Acid SCHEMBL2891986 0.90 KCNA5 (0.44) KCNA5ABCB1IDO1ALDH1A1TAAR1
Maleic Acid SCHEMBL2891985 0.90 KCNA5 (0.44) KCNA5ABCB1IDO1ALDH1A1TAAR1
SCHEMBL2887577 0.86 KCNA5 (0.48) KCNA5ABCB1IDO1
Hydrochloric Acid SCHEMBL2891525 0.85 KCNA5 (0.47) KCNA5ABCB1IDO1
SCHEMBL2883892 0.83 KCNA5 (0.46) KCNA5ABCB1IDO1
SCHEMBL2887648 0.83 KCNA5 (0.50) KCNA5ABCB1IDO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1718629-B1 Benzopyran compounds useful for the treatment of arrhytmia NISSAN CHEMICAL IND LTD (JP) 2012-12-26 EP claimed
US-20070299130-A1 Benzopyran Compound NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2007-12-27 US claimed
EP-1718629-B1 Benzopyran compounds useful for the treatment of arrhytmia NISSAN CHEMICAL IND LTD (JP) 2012-12-26 EP disclosed
US-7781483-B2 Benzopyran compound NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2010-08-24 US disclosed
US-20070299130-A1 Benzopyran Compound NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2007-12-27 US disclosed
EP-1718629-A2 BENZOPYRAN COMPOUNDS USEFUL FOR THE TREATMENT OF ARRHYTMIA Nissan Chemical Industries, Ltd. (JP) 2006-11-08 EP disclosed
WO-2005080368-A2 BENZOPYRAN COMPOUND USEFUL FOR THE TREATMENT OF ARRHYTMIA NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2005-09-01 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070299130-A1 Benzopyran Compound NR0B1, CYP2B6, RYR2 KCNA5 69/4885ABCB1 978/4885OPRM1 532/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.