Maleic Acid

Maleic Acid

SCHEMBL6889391

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

nearest known ligand 0.60

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 4/20 0.60
TP53 P04637 1/20 0.60
EGLN1 Q9GZT9 1/20 0.60
EGLN3 Q9H6Z9 1/20 0.60
HCAR2 Q8TDS4 3/20 0.39
ALDH1A1 P00352 6/20 0.35
GABRR1 P24046 2/20 0.35
GABRR2 P28476 2/20 0.35
BLM P54132 2/20 0.35
TDP1 Q9NUW8 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
GABRR3 A8MPY1 1/20 0.35
LMNA P02545 1/20 0.35
APEX1 P27695 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
GAA P10253 1/20 0.35
ALOX15 P16050 1/20 0.35
RECQL P46063 1/20 0.35
HSD17B10 Q99714 1/20 0.35
KMT2A Q03164 2/20 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
Fumaric Acid SCHEMBL3171992 1.00 TSHR (0.60) TSHRTP53EGLN1EGLN3HCAR2
Fumaric Acid SCHEMBL3171979 1.00 TSHR (0.60) TSHRTP53EGLN1EGLN3HCAR2
Trifluoroacetic Acid SCHEMBL2715318 0.86
Trifluoroacetic Acid SCHEMBL7814389 0.82 ALDH1A1 (0.44) TSHRTP53ALDH1A1L3MBTL1KMT2A
Trifluoroacetic Acid SCHEMBL2484766 0.82 ALDH1A1 (0.44) TSHRTP53ALDH1A1L3MBTL1KMT2A
Trifluoroacetic Acid SCHEMBL30657022 0.82
Trifluoroacetic Acid SCHEMBL4598430 0.82
Trifluoroacetic Acid SCHEMBL474 0.82
SCHEMBL30333488 0.81 TSHR (0.53) TSHRTP53EGLN1EGLN3HCAR2
SCHEMBL22382306 0.81 TSHR (0.53) TSHRTP53EGLN1EGLN3HCAR2

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-20020132821-A1 Novel heteroaryl derivatives and their use as medicaments ZENTARIS GMBH (DE) 2002-09-19 US claimed
US-20180071284-A1 PREVENTING OR TREATING VIRAL INFECTION BY INHIBITION OF THE HISTONE METHYLTRANSFERASE EZH1 OR EZH2 THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERV (US) 2018-03-15 US disclosed
US-6706722-B2 IN PARTICULAR FOR TREATING TUMORS. ZENTARIS AG (DE) 2004-03-16 US disclosed
US-20020132821-A1 Novel heteroaryl derivatives and their use as medicaments ZENTARIS GMBH (DE) 2002-09-19 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-20180071284-A1 PREVENTING OR TREATING VIRAL INFECTION BY INHIBITION OF THE HISTONE METHYLTRANSFERASE EZH1 OR EZH2 EZH2, EZH1, EHMT1 TSHR 3930/4885TP53 1206/4885EGLN1 150/4885
US-20020132821-A1 Novel heteroaryl derivatives and their use as medicaments ABCB1, ABCB11, FANCD2 TSHR 3914/4885TP53 133/4885EGLN1 3702/4885

“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.