Maleic Acid

Maleic Acid

SCHEMBL2007221

CC1(C)Oc2cc3c(cc2[C@H](NCCc2ccccc2)[C@H]1O)NCCO3.O=C(O)/C=C\C(=O)O

nearest known ligand 0.42

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 11)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 6/20 0.42
KCNA5 P22460 7/20 0.40
ALDH1A1 P00352 1/20 0.34
TAAR1 Q96RJ0 1/20 0.34
TRPV1 Q8NER1 2/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
KLF5 Q13887 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34

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 SCHEMBL3598910 1.00 ABCB1 (0.42) ABCB1KCNA5ALDH1A1TAAR1TRPV1
Fumaric Acid SCHEMBL2881096 1.00 ABCB1 (0.42) ABCB1KCNA5ALDH1A1TAAR1TRPV1
Maleic Acid SCHEMBL2889050 0.97 ABCB1 (0.42) ABCB1KCNA5ALDH1A1TAAR1L3MBTL1
Maleic Acid SCHEMBL2889054 0.97 ABCB1 (0.42) ABCB1KCNA5ALDH1A1TAAR1L3MBTL1
Fumaric Acid SCHEMBL2878032 0.97 ABCB1 (0.42) ABCB1KCNA5ALDH1A1TAAR1L3MBTL1
SCHEMBL2009000 0.94 ABCB1 (0.46) ABCB1KCNA5TAAR1L3MBTL1MEN1
SCHEMBL2009002 0.94 ABCB1 (0.46) ABCB1KCNA5TAAR1L3MBTL1MEN1
SCHEMBL12580681 0.90 ABCB1 (0.46) ABCB1KCNA5TAAR1L3MBTL1MEN1
SCHEMBL2006612 0.90 ABCB1 (0.46) ABCB1KCNA5TAAR1L3MBTL1MEN1
SCHEMBL2013291 0.80 TP53 (0.47) ABCB1KCNA5ALDH1A1TAAR1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7964623-B2 Tricyclic benzopyrane compound NISSAN CHEMICAL INDUSTRIES LTD. (JP) 2011-06-21 US disclosed
EP-1732929-B1 TRICYCLIC BENZOPYRAN COMPOUND AS ANTI-ARRHYTHMIC AGENTS NISSAN CHEMICAL IND LTD (JP) 2010-10-20 EP disclosed
US-20100069374-A1 Tricyclic benzopyrane compound NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2010-03-18 US disclosed
US-20080004262-A1 Tricyclic Benzopyrane Compound as Anti-Arrhythmic Agents NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2008-01-03 US 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 (2 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-20100069374-A1 Tricyclic benzopyrane compound CBR1, CBR3, CYP2C9 ABCB1 647/4885KCNA5 101/4885ALDH1A1 2252/4885
US-20080004262-A1 Tricyclic Benzopyrane Compound as Anti-Arrhythmic Agents CBR1, CBR3, SCN8A ABCB1 580/4885KCNA5 67/4885ALDH1A1 2087/4885

“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.