Maleic Acid

Maleic Acid

SCHEMBL8534291

COc1ccc(C(=O)c2c(C)n(CC3CCCN3C)c3ccccc23)cc1.O=C(O)/C=C\C(=O)O

nearest known ligand 0.89

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 2)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 2/20 0.56
HTR6 P50406 1/20 0.44

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 SCHEMBL8534296 1.00 CNR1 (0.56) CNR1HTR6
SCHEMBL9301997 0.94 CNR1 (0.62) CNR1HTR6
Hydrochloric Acid SCHEMBL8583401 0.93 CNR1 (0.61) CNR1HTR6
SCHEMBL9302345 0.91 CNR1 (0.61) CNR1
SCHEMBL9303207 0.87 CNR1 (0.63) CNR1
SCHEMBL8534987 0.83 CNR1 (0.54) CNR1
Hydrochloric Acid SCHEMBL8533745 0.82 ADRA2A (0.46) CNR1HTR6
Fumaric Acid SCHEMBL9691196 0.81 CNR1 (0.61) CNR1
Maleic Acid SCHEMBL9691190 0.81 CNR1 (0.61) CNR1
SCHEMBL8535059 0.81 CNR1 (0.58) CNR1

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-5817651-A ANALGESICS, RHEUMATIC DISEASES, ANTIINFLAMMATORY AGENTS SANOFI (FR) 1998-10-06 US disclosed
US-5324737-A Analgesics, antirheumatic and antiinflammatory agents, glaucoma STERLING WINTHROP INC. (US) 1994-06-28 US disclosed
US-5068234-A Analgesics, rheumatic diseases, antiinflammatory agents or antiglaucoma STERLING DRUG INC. (US) 1991-11-26 US disclosed
EP-0444451-A2 3-Arylcarbonyl-1H-indoles useful as therapeutic agents STERLING WINTHROP INC. (US) 1991-09-04 EP disclosed