Maleic Acid

Maleic Acid

SCHEMBL7102511

CS(=O)(=O)Nc1cccc2c1OCCC2c1c[nH]cn1.O=C(O)/C=C\C(=O)O

nearest known ligand 0.56

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
ADRA1A known ✓ P35348 5/20 0.39
ADRA2A known ✓ P08913 6/20 0.38
ADRA2B known ✓ P18089 3/20 0.33
ADRA2C known ✓ P18825 2/20 0.31
KCNH2 Q12809 2/20 0.35
TRPV1 Q8NER1 1/20 0.34
MMP2 P08253 1/20 0.33
MRGPRX1 Q96LB2 1/20 0.32
KMT2A Q03164 2/20 0.32
MEN1 O00255 1/20 0.32
ALDH1A1 P00352 1/20 0.32

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
Fumaric Acid SCHEMBL7102519 1.00 ADRA1A (0.39) ADRA1AADRA2AKCNH2TRPV1ADRA2B
SCHEMBL7103530 0.92 ADRA1A (0.43) ADRA1AADRA2ATRPV1ADRA2BADRA2C
Maleic Acid SCHEMBL7102529 0.85 TRPV1 (0.32) TRPV1
Fumaric Acid SCHEMBL7102536 0.85 TRPV1 (0.32) TRPV1
SCHEMBL7101615 0.82 ADRA2A (0.46) ADRA1AADRA2AADRA2BADRA2C
SCHEMBL7105127 0.77 ADRA2A (0.48) ADRA1AADRA2AADRA2BADRA2C
Fumaric Acid SCHEMBL7247808 0.77 ADRA2A (0.31) ADRA1AADRA2AMRGPRX1
Maleic Acid SCHEMBL7247796 0.77 ADRA2A (0.31) ADRA1AADRA2AMRGPRX1
SCHEMBL7102119 0.77 ADRA1A (0.62) ADRA1AADRA2A
SCHEMBL7103690 0.77 BRAF (0.33) ADRA1AADRA2ATRPV1

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
US-20030073850-A1 4-Imidazole derivatives of benzyl and restricted benzyl sulfonamides, sulfamides, ureas, carbamates, and amides and their use ABBOTT LABORATORIES 2003-04-17 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 (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-20030073850-A1 4-Imidazole derivatives of benzyl and restricted benzyl sulfonamides, sulfamides, ureas, carbamates, and amides and their use ADRA1D, ADRB1, ADRA1A ADRA1A 3/4885ADRA2A 8/4885ADRA2B 13/4885

“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.