Maleic Acid

Maleic Acid

SCHEMBL4613433

C=CC=CC(C=Cc1ccccc1)=Cc1ccccc1.O=C(O)/C=C\C(=O)O

nearest known ligand 0.55

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 20)

geneUniProtsupporting neighboursconfidence
DPP4 known ✓ P27487 1/20 0.40
EGFR known ✓ P00533 1/20 0.39
HDAC3 O15379 3/20 0.55
HDAC4 P56524 3/20 0.55
HDAC1 Q13547 3/20 0.55
HDAC2 Q92769 3/20 0.55
HDAC8 Q9BY41 3/20 0.55
HDAC6 Q9UBN7 3/20 0.55
HCAR2 Q8TDS4 2/20 0.55
HDAC7 Q8WUI4 2/20 0.55
HDAC10 Q969S8 2/20 0.55
HDAC11 Q96DB2 2/20 0.55
HDAC9 Q9UKV0 2/20 0.55
HDAC5 Q9UQL6 2/20 0.55
TNKS O95271 1/20 0.55
TNKS2 Q9H2K2 1/20 0.55
MAPT P10636 3/20 0.46
ALDH1A1 P00352 3/20 0.46
PLIN1 O60240 2/20 0.46
LMNA P02545 2/20 0.46

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
SCHEMBL251204 0.92 HDAC3 (0.46) HDAC3HDAC4HDAC1HDAC2HDAC8
SCHEMBL954016 0.92 ALDH1A1 (0.44) HDAC3HDAC4HDAC1HDAC2HDAC8
SCHEMBL24093 0.92 ALDH1A1 (0.44) HDAC3HDAC4HDAC1HDAC2HDAC8
SCHEMBL9422101 0.92 ALDH1A1 (0.44) HDAC3HDAC4HDAC1HDAC2HDAC8
Water SCHEMBL6447465 0.90 MAPT (0.42) HDAC3HDAC4HDAC1HDAC2HDAC8
Butadiene SCHEMBL9420166 0.90 MAPT (0.42) HDAC3HDAC4HDAC1HDAC2HDAC8
SCHEMBL4101735 0.87 HDAC3 (0.67) HDAC3HDAC4HDAC1HDAC2HDAC8
SCHEMBL5337661 0.85 ALDH1A1 (0.42) HDAC3HDAC4HDAC1HDAC2HDAC8
SCHEMBL1579931 0.84 HDAC3 (0.53) HDAC3HDAC4HDAC1HDAC2HDAC8
SCHEMBL5141317 0.81 HDAC3 (0.47) HDAC3HDAC4HDAC1HDAC2HDAC8

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-1446518-B9 POLYOLEFIN-BASED SYNTHETIC FIBERS AND PRODUCTION METHOD THEREOF AQUAFIL S P A (IT) 2008-03-05 EP claimed
EP-1446518-B1 POLYOLEFIN-BASED SYNTHETIC FIBERS AND PRODUCTION METHOD THEREOF AQUAFIL S P A (IT) 2007-10-10 EP claimed