Maleic Acid

Maleic Acid

SCHEMBL9230985

CN(C)CCCOc1ccc(-c2nn(C)c3ncccc23)cc1.O=C(O)/C=C\C(=O)O

nearest known ligand 0.48

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 12)

geneUniProtsupporting neighboursconfidence
HRH3 known ✓ Q9Y5N1 4/20 0.42
HRH1 known ✓ P35367 1/20 0.41
LSS P48449 3/20 0.48
NAMPT P43490 3/20 0.46
BCHE P06276 3/20 0.43
ACHE P22303 3/20 0.43
SMN1; SMN2 Q16637 2/20 0.41
MAPK1 P28482 1/20 0.41
LMNA P02545 1/20 0.41
HPGD P15428 1/20 0.41
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40

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 SCHEMBL9230988 1.00 LSS (0.48) LSSNAMPTBCHEACHEHRH3
Fumaric Acid SCHEMBL9232176 0.88 GSK3B (0.42) LSSBCHEACHEHRH1KDM4E
Maleic Acid SCHEMBL9232171 0.88 GSK3B (0.42) LSSBCHEACHEHRH1KDM4E
Maleic Acid SCHEMBL9230995 0.88 LSS (0.45) LSSBCHEACHEHRH1KDM4E
Fumaric Acid SCHEMBL9231005 0.88 LSS (0.45) LSSBCHEACHEHRH1KDM4E
Fumaric Acid SCHEMBL10591933 0.87 LSS (0.41) LSSBCHEACHEHRH3SMN1; SMN2
Fumaric Acid SCHEMBL9234273 0.86 LSS (0.41) LSSNAMPTBCHEACHESMN1; SMN2
Fumaric Acid SCHEMBL9234267 0.86 LSS (0.41) LSSNAMPTBCHEACHESMN1; SMN2
Fumaric Acid SCHEMBL9237908 0.86 ALDH1A1 (0.48) LSSBCHEACHESMN1; SMN2HRH1
Maleic Acid SCHEMBL9237900 0.86 ALDH1A1 (0.48) LSSBCHEACHESMN1; SMN2HRH1

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
EP-0641564-A1 OPTICALLY ACTIVE CONDENSED PYRAZOLE COMPOUND FOR USE IN TREATING THROMBOCYTOPENIA AND ERYTHROPENIA YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1995-03-08 EP disclosed
EP-0338087-A1 FUSED PYRAZOLE COMPOUNDS, PROCESS FOR THEIR PREPARATION, AND THEIR MEDICINAL USE Yoshitomi Pharmaceutical Industries, Ltd. (JP) 1989-10-25 EP disclosed