Maleic Acid

Maleic Acid

SCHEMBL4395451

CC(C)(C)C(=O)OCOP(=O)(COC1(Cn2cnc3cnc(N)nc32)CC1)OCCC(C)(C)C(=O)O.O=C(O)/C=C\C(=O)O

nearest known ligand 0.40

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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 12)

geneUniProtsupporting neighboursconfidence
ADRA1A known ✓ P35348 1/20 0.34
FAP Q12884 2/20 0.40
ABCB11 O95342 1/20 0.40
POLA1 P09884 1/20 0.40
POLG P54098 1/20 0.40
SLC22A6 Q4U2R8 1/20 0.40
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
HPGD P15428 1/20 0.34
HSD17B10 Q99714 1/20 0.34
RXFP1 Q9HBX9 1/20 0.34
HDAC6 Q9UBN7 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
SCHEMBL2912291 0.96 ABCB11 (0.42) FAPABCB11POLA1POLGSLC22A6
SCHEMBL4415990 0.93 ABCB11 (0.40) FAPABCB11POLA1POLGSLC22A6
SCHEMBL4419762 0.93 ABCB11 (0.40) FAPABCB11POLA1POLGSLC22A6
Malic Acid SCHEMBL27872847 0.90 ABCB11 (0.38) FAPABCB11POLA1POLGSLC22A6
Lb80380 SCHEMBL4270816 0.89 FAP (0.46) FAPABCB11POLA1POLGSLC22A6
Lb80380 SCHEMBL29355183 0.89 FAP (0.46) FAPABCB11POLA1POLGSLC22A6
SCHEMBL4422979 0.88 ABCB11 (0.36) FAPABCB11POLA1POLGSLC22A6
SCHEMBL2912357 0.87 ABCB11 (0.42) FAPABCB11POLA1POLGSLC22A6
SCHEMBL2939529 0.86 ABCB11 (0.40) FAPABCB11POLA1POLGSLC22A6
SCHEMBL4428566 0.86 ABCB11 (0.35) FAPABCB11POLA1POLGSLC22A6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090325904-A1 MALEIC ACID MONOSALT OF ANTIVIRAL AGENT AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME LG LIFE SCIENCES LTD. (KR) 2009-12-31 US claimed
US-20090325904-A1 MALEIC ACID MONOSALT OF ANTIVIRAL AGENT AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME LG LIFE SCIENCES LTD. (KR) 2009-12-31 US disclosed
US-20090325904-A1 MALEIC ACID MONOSALT OF ANTIVIRAL AGENT AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME LG LIFE SCIENCES LTD. (KR) 2009-12-31 US disclosed
EP-2124953-A1 MALEIC ACID MONOSALT OF ANTIVIRAL AGENT AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME LG Life Sciences Ltd. (KR) 2009-12-02 EP disclosed
WO-2008088147-A1 MALEIC ACID MONOSALT OF ANTIVIRAL AGENT AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME LG LIFE SCIENCES LTD. (KR) 2008-07-24 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-20090325904-A1 MALEIC ACID MONOSALT OF ANTIVIRAL AGENT AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME MPST, GART, DIMT1 ADRA1A 4042/4885FAP 1609/4885ABCB11 3730/4885

“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.