Maleic Acid

Maleic Acid

SCHEMBL11176338

CCN(CC)C(C)Cn1cc(-c2ccccc2)c2ccc(OC)cc2c1=O.O=C(O)/C=C\C(=O)O

nearest known ligand 0.41

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 0.41
▸ LMNA P02545 3/20 0.40
▸ GFER P55789 1/20 0.40
▸ KCNA5 P22460 3/20 0.40
▸ KCNH2 Q12809 2/20 0.40
▸ KMT2A Q03164 3/20 0.39
▸ BRD4 O60885 1/20 0.39
▸ HDAC8 Q9BY41 2/20 0.39
▸ MAPK8 P45983 1/20 0.38
▸ KDM4E B2RXH2 3/20 0.38
▸ ALDH1A1 P00352 3/20 0.38
▸ SMN1; SMN2 Q16637 3/20 0.38
▸ HPGD P15428 2/20 0.38
▸ MEN1 O00255 2/20 0.38
▸ POLB P06746 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ NPSR1 Q6W5P4 1/20 0.37
▸ HDAC3 O15379 1/20 0.37
▸ HDAC1 Q13547 1/20 0.37
▸ NCOR2 Q9Y618 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
Hydrochloric Acid SCHEMBL11185605 0.87 KMT2A (0.41) DPP4LMNAGFERKMT2ABRD4
Maleic Acid SCHEMBL11175151 0.87 BRD4 (0.45) KCNH2BRD4MAPT
Maleic Acid SCHEMBL11185760 0.81 POLB (0.39) DPP4KMT2ABRD4MEN1POLB
SCHEMBL11173789 0.80 BRD4 (0.51) DPP4KCNH2BRD4KDM4EALDH1A1
Hydrochloric Acid SCHEMBL11182898 0.79 BRD4 (0.50) DPP4KCNH2BRD4KDM4EALDH1A1
Maleic Acid SCHEMBL11180357 0.78 TDP1 (0.41) LMNAGFERKMT2AKDM4EALDH1A1
Maleic Acid SCHEMBL11110935 0.78 BRD4 (0.42) LMNABRD4MAPTTP53
SCHEMBL11178740 0.77 MAPT (0.47) KMT2ABRD4KDM4EALDH1A1HPGD
Maleic Acid SCHEMBL11172316 0.77 BRD4 (0.46) LMNAKMT2ABRD4SMN1; SMN2MEN1
Maleic Acid SCHEMBL11177984 0.74 HTR2A (0.44) LMNAGFERKCNA5KCNH2KMT2A

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
US-4393210-A ANALGESIC, ANTIULCER, ANTIDEPRESSANT, ANTIHISTAMINE, ANTICHOLINERGIC SEIYAKU CO., LTD. (JP) 1983-07-12 — — US disclosed
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