Maleic Acid

Maleic Acid

SCHEMBL5565097

CCCN1CCN(c2ccc(C(=O)NC3(C(=O)N(C)C#N)CCCCC3)cc2)CC1.O=C(O)/C=C\C(=O)O

nearest known ligand 0.65

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 7)

geneUniProtsupporting neighboursconfidence
DRD2 known ✓ P14416 2/20 0.39
CTSB P07858 15/20 0.65
CTSL P07711 15/20 0.65
CTSS P25774 13/20 0.65
CTSK P43235 5/20 0.65
CTSD P07339 1/20 0.65
DRD4 P21917 2/20 0.39

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
SCHEMBL4576260 0.95 CTSB (0.72) CTSBCTSLCTSSCTSKCTSD
SCHEMBL4577119 0.87 CTSB (0.60) CTSBCTSLCTSSCTSKCTSD
Maleic Acid SCHEMBL4576156 0.86 CTSB (0.48) CTSBCTSLCTSSCTSKCTSD
Fumaric Acid SCHEMBL1838249 0.86 CTSL (0.67) CTSBCTSLCTSSCTSKCTSD
Fumaric Acid SCHEMBL1838246 0.86 CTSL (0.67) CTSBCTSLCTSSCTSKCTSD
SCHEMBL4576791 0.86 CTSB (0.59) CTSBCTSLCTSSCTSKCTSD
Balicatib SCHEMBL5565100 0.85 CTSB (0.90) CTSBCTSLCTSSCTSKCTSD
SCHEMBL4576702 0.84 CTSB (0.68) CTSBCTSLCTSSCTSKCTSD
SCHEMBL4577313 0.83 CTSL (0.54) CTSBCTSLCTSSCTSKCTSD
SCHEMBL1840958 0.81 CTSL (0.73) CTSBCTSLCTSSCTSKCTSD

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-20070135448-A1 Use of cathepsin k inhibitors for treating of severe bone loss diseases MISSBACH MARTIN 2007-06-14 US claimed
EP-1686995-A1 USE OF CATHEPSIN K INHIBITORS FOR TREATING OF SEVERE BONE LOSS DISEASES Novartis AG (CH) 2006-08-09 EP claimed
WO-2006063762-A1 DIPEPTIDE NITRILES NOVARTIS AG (CH) 2006-06-22 WO claimed
WO-2005049028-A1 USE OF CATHEPSIN K INHIBITORS IN SEVERE BONE LOSS DISEASES NOVARTIS AG (CH) 2005-06-02 WO claimed
WO-2006063762-A1 DIPEPTIDE NITRILES NOVARTIS AG (CH) 2006-06-22 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-20070135448-A1 Use of cathepsin k inhibitors for treating of severe bone loss diseases CTSK, CTSB, CTSZ DRD2 4681/4885CTSB 2/4885CTSL 10/4885

“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.