Maleic Acid

Maleic Acid

SCHEMBL9375437

O=C(O)/C=C\C(=O)O.O=C1CCCN1C(=O)NCCCN1CC=C(c2ccccc2)CC1

nearest known ligand 0.46

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 14)

geneUniProtsupporting neighboursconfidence
HTR1A known ✓ P08908 3/20 0.46
SIGMAR1 Q99720 4/20 0.46
HTR7 P34969 2/20 0.43
DRD3 P35462 1/20 0.42
KDM4E B2RXH2 2/20 0.41
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
LMNA P02545 1/20 0.41
MAPT P10636 1/20 0.41
PARP1 P09874 5/20 0.41
ALOX15 P16050 1/20 0.41
APEX1 P27695 1/20 0.41
HSD17B10 Q99714 1/20 0.41
TDP1 Q9NUW8 1/20 0.41

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 SCHEMBL9375443 1.00 SIGMAR1 (0.46) SIGMAR1HTR1AHTR7DRD3KDM4E
SCHEMBL7335487 0.90 SIGMAR1 (0.47) SIGMAR1HTR1AHTR7DRD3KDM4E
SCHEMBL9372501 0.85 SIGMAR1 (0.52) SIGMAR1HTR1APARP1
SCHEMBL7333358 0.83 HTR1A (0.48) SIGMAR1HTR1AHTR7KDM4EPARP1
SCHEMBL7299309 0.82 SIGMAR1 (0.49) SIGMAR1DRD3KDM4EKMT2AMEN1
SCHEMBL7297853 0.82 SIGMAR1 (0.48) SIGMAR1HTR1AHTR7KDM4EKMT2A
SCHEMBL9735887 0.80 PARP1 (0.45) SIGMAR1HTR1AHTR7DRD3PARP1
SCHEMBL7304233 0.79 SIGMAR1 (0.49) SIGMAR1HTR1AHTR7DRD3KMT2A
SCHEMBL9371817 0.79 HTR1A (0.56) SIGMAR1HTR1A
SCHEMBL7335481 0.73 SIGMAR1 (0.47) SIGMAR1HTR1AHTR7KDM4EKMT2A

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
EP-0304330-B1 Carbamoylpyrrolidone derivatives, their use and preparation SHIONOGI & CO (JP) 1994-03-30 EP disclosed
US-5202345-A Carbamoylpyrrolidone derivatives and drugs for senile dementia SHIONOGI & CO., LTD. (JP) 1993-04-13 US disclosed
US-5120733-A Cognition activators and psychological disorders SHIONOGI AND CO. LTD. (JP) 1992-06-09 US disclosed
EP-0304330-A1 Carbamoylpyrrolidone derivatives, their use and preparation SHIONOGI SEIYAKU KABUSHIKI KAISHA trading under the name of SHIONOGI & CO. LTD. (JP) 1989-02-22 EP disclosed