Maleic Acid

Maleic Acid

SCHEMBL10409470

O=C(O)/C=C\C(=O)O.O=S(=O)(CCNCCN1CCCC1)c1ccccc1

nearest known ligand 0.48

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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 15)

geneUniProtsupporting neighboursconfidence
HRH1 known ✓ P35367 1/20 0.40
SIGMAR1 Q99720 2/20 0.48
POLB P06746 3/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
DPP7 Q9UHL4 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.44
RAB9A P51151 3/20 0.42
EPHX2 P34913 1/20 0.41
HSP90AA1 P07900 1/20 0.40
BCHE P06276 2/20 0.40
ACHE P22303 2/20 0.40
KDM1A O60341 1/20 0.40
NPC1 O15118 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 SCHEMBL10409472 1.00 SIGMAR1 (0.48) SIGMAR1POLBMEN1KMT2ASMN1; SMN2
Fumaric Acid SCHEMBL10409444 0.99 POLB (0.48) SIGMAR1POLBMEN1KMT2ASMN1; SMN2
Fumaric Acid SCHEMBL10409412 0.99 POLB (0.48) SIGMAR1POLBMEN1KMT2ASMN1; SMN2
Maleic Acid SCHEMBL10409441 0.99 POLB (0.48) SIGMAR1POLBMEN1KMT2ASMN1; SMN2
Maleic Acid SCHEMBL10409408 0.99 POLB (0.48) SIGMAR1POLBMEN1KMT2ASMN1; SMN2
SCHEMBL10409586 0.91 SIGMAR1 (0.56) SIGMAR1POLBMEN1KMT2ASMN1; SMN2
SCHEMBL10409579 0.90 SIGMAR1 (0.55) SIGMAR1POLBMEN1KMT2ASMN1; SMN2
SCHEMBL10409520 0.90 SIGMAR1 (0.55) SIGMAR1POLBMEN1KMT2ASMN1; SMN2
Fumaric Acid SCHEMBL10409548 0.89 MEN1 (0.62) POLBMEN1KMT2ASMN1; SMN2RAB9A
Maleic Acid SCHEMBL10409547 0.89 MEN1 (0.62) POLBMEN1KMT2ASMN1; SMN2RAB9A

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
US-4895840-A ANTIARRHYTHMIA AGENTS A. H. ROBINS COMPANY, INCORPORATED (US) 1990-01-23 US disclosed
EP-0295010-A1 Derivatives of alkylaminoalkyl ureas and cyanoguanidines A.H. ROBINS COMPANY, INCORPORATED (US) 1988-12-14 EP disclosed