Maleic Acid

Maleic Acid

SCHEMBL11264466

Cc1nccn1CCOc1cc(Cl)c(Cl)c(Cl)c1.O=C(O)/C=C\C(=O)O

nearest known ligand 0.61

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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 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.43
KDM4E B2RXH2 2/20 0.43
HTT P42858 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
MCL1 Q07820 3/20 0.40
KMT2A Q03164 2/20 0.40
POLB P06746 2/20 0.38
HPGD P15428 1/20 0.38
TBXAS1 P24557 1/20 0.37

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
Maleic Acid SCHEMBL11263894 0.90 ALDH1A1 (0.43) ALDH1A1KDM4EHTTSMN1; SMN2MCL1
Maleic Acid SCHEMBL11250986 0.90 MCL1 (0.50) ALDH1A1KDM4EHTTSMN1; SMN2MCL1
Maleic Acid SCHEMBL11258141 0.82 KMT2A (0.42) ALDH1A1KDM4EHTTSMN1; SMN2KMT2A
Maleic Acid SCHEMBL11241428 0.81 KDM4E (0.50) ALDH1A1KDM4EHTTSMN1; SMN2KMT2A
Maleic Acid SCHEMBL11260650 0.80 ALDH1A1 (0.50) ALDH1A1KDM4EHTTSMN1; SMN2KMT2A
Maleic Acid SCHEMBL11248410 0.79 KDM4E (0.58) ALDH1A1KDM4EHTTSMN1; SMN2KMT2A
SCHEMBL11240131 0.77 ALDH1A1 (0.47) ALDH1A1KDM4EHTTSMN1; SMN2KMT2A
Maleic Acid SCHEMBL11250777 0.77 KDM4E (0.48) ALDH1A1KDM4EHTTMCL1KMT2A
SCHEMBL11251413 0.77 KDM4E (0.49) ALDH1A1KDM4EKMT2APOLB
Maleic Acid SCHEMBL11253828 0.74 KDM4E (0.50) ALDH1A1KDM4EHTTSMN1; SMN2KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0049060-A1 Imidazoles BEECHAM GROUP PLC (GB) 1982-04-07 EP disclosed