Maleic Acid

Maleic Acid

SCHEMBL5409088

O=C(O)/C=C\C(=O)O.O=C1COCO1

nearest known ligand 0.39

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 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.39
TP53 P04637 1/20 0.39
EGLN1 Q9GZT9 1/20 0.39
EGLN3 Q9H6Z9 1/20 0.39
KDM4E B2RXH2 2/20 0.33
ALDH1A1 P00352 2/20 0.33
MAPT P10636 2/20 0.33
PKM P14618 1/20 0.33
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
NFKB1 P19838 1/20 0.31
CA4 P22748 1/20 0.31
HCAR2 Q8TDS4 3/20 0.31
HDAC3 O15379 1/20 0.31
TNKS O95271 1/20 0.31
HDAC4 P56524 1/20 0.31
HDAC1 Q13547 1/20 0.31
HDAC7 Q8WUI4 1/20 0.31
HDAC2 Q92769 1/20 0.31
HDAC10 Q969S8 1/20 0.31

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 SCHEMBL5409099 1.00 TSHR (0.39) TSHRTP53EGLN1EGLN3KDM4E
Fumaric Acid SCHEMBL5608790 0.81 TSHR (0.47) TSHRTP53EGLN1EGLN3KDM4E
SCHEMBL1336671 0.81
Fumaric Acid SCHEMBL5608821 0.80 TSHR (0.41) TSHRTP53EGLN1EGLN3KDM4E
SCHEMBL17672290 0.70 TSHR (0.37) TSHRTP53ALDH1A1
Maleic Acid SCHEMBL27770052 0.67 TSHR (0.47) TSHRTP53EGLN1EGLN3KDM4E
Fumaric Acid SCHEMBL28230141 0.67 TSHR (0.64) TSHRTP53EGLN1EGLN3ALDH1A1
Maleic Acid SCHEMBL7183468 0.67 TSHR (0.64) TSHRTP53EGLN1EGLN3ALDH1A1
Fumaric Acid SCHEMBL7183473 0.67 TSHR (0.64) TSHRTP53EGLN1EGLN3ALDH1A1
Fumaric Acid SCHEMBL31590086 0.66

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
US-7169803-B2 N-substituted prodrugs of fluorooxindoles BRISTOL-MYERS SQUIBB COMPANY (US) 2007-01-30 US disclosed
US-20050203089-A1 N-substituted prodrugs of fluorooxindoles BRISTOL-MYERS SQUIBB COMPANY 2005-09-15 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-20050203089-A1 N-substituted prodrugs of fluorooxindoles KCNA5, KCNQ5, KCNQ2 TSHR 2192/4885TP53 2554/4885EGLN1 4150/4885

“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.