Fumaric Acid

Fumaric Acid

SCHEMBL3962476

CCOC(=O)c1cc2c(ccc3cnn(CC(C)N)c32)o1.O=C(O)C=CC(=O)O

nearest known ligand 0.60

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACEADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ATP4AATP4BAXLBTKCACNA1CCACNA1DCACNA1FCACNA1SCCR5CHRM2CHRM3CPT1BCPT2DPP4DRD1DRD2EGFRERBB2ERBB4FLT3HRH1HRH3HTR1AHTR2AHTR2BHTR2CHTR4JAK1JAK2JAK3KCNH2KMT2AMAP2K1MAP2K2MEN1MLNRMPLMTORPPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PLK4PPARGRENS1PR1SLC6A2SLC6A3SLC6A4SMOTYK2atpAatpBatpCatpDatpEatpFatpFHatpGpol

The experimentally established mechanism targets of Fumaric Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HTR2C known ✓ P28335 18/20 0.60
HTR2A known ✓ P28223 17/20 0.60
HTR2B known ✓ P41595 7/20 0.58
HTR1A known ✓ P08908 2/20 0.38
ADRA2A known ✓ P08913 2/20 0.38
ADRA2B known ✓ P18089 2/20 0.38
ADRA2C known ✓ P18825 2/20 0.38
HTR4 known ✓ Q13639 1/20 0.38
MAOB P27338 1/20 0.42
AKR1B1 P15121 1/20 0.39
HTR1D P28221 1/20 0.38
HTR7 P34969 1/20 0.38

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 SCHEMBL3962479 1.00 HTR2C (0.60) HTR2CHTR2AHTR2BMAOBAKR1B1
Fumaric Acid SCHEMBL3962471 1.00 HTR2C (0.60) HTR2CHTR2AHTR2BMAOBAKR1B1
Fumaric Acid SCHEMBL6195912 0.86 HTR2C (0.81) HTR2CHTR2AHTR2BHTR1AADRA2A
Fumaric Acid SCHEMBL6195915 0.86 HTR2C (0.81) HTR2CHTR2AHTR2BHTR1AADRA2A
Fumaric Acid SCHEMBL3957101 0.85 HTR2C (0.60) HTR2CHTR2AHTR2BHTR1AADRA2A
Fumaric Acid SCHEMBL3957103 0.85 HTR2C (0.60) HTR2CHTR2AHTR2BHTR1AADRA2A
SCHEMBL3965543 0.84 HTR2C (0.67) HTR2CHTR2AHTR2BHTR1AADRA2A
SCHEMBL3965549 0.84 HTR2C (0.67) HTR2CHTR2AHTR2BHTR1AADRA2A
SCHEMBL3957133 0.83 HTR2C (0.71) HTR2CHTR2AHTR2BHTR1AADRA2A
SCHEMBL3957137 0.83 HTR2C (0.71) HTR2CHTR2AHTR2BHTR1AADRA2A

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-7476687-B2 Substituted furo[2,3-g]indazoles for the treatment of glaucoma ALCON, INC. (CH) 2009-01-13 US disclosed
US-20090012291-A1 SUBSTITUTED FURO[2,3-g]INDAZOLES FOR THE TREATMENT OF GLAUCOMA ALCON, INC. (CH) 2009-01-08 US disclosed
US-20070135430-A1 Substituted furo[2,3-g]indazoles for the treatment of glaucoma ALCON, INC. (CH) 2007-06-14 US disclosed
WO-2005053688-A1 SUBSTITUTED FURO[2,3-G] INDAZOLES FOR THE TREATMENT OF GLAUCOMA ALCON, INC. (CH) 2005-06-16 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070135430-A1 Substituted furo[2,3-g]indazoles for the treatment of glaucoma PTGIS, PTGIR, PTGS2 HTR2C 646/4885HTR2A 1195/4885HTR2B 1055/4885
US-20090012291-A1 SUBSTITUTED FURO[2,3-g]INDAZOLES FOR THE TREATMENT OF GLAUCOMA PTGIS, PTGIR, PTGS2 HTR2C 646/4885HTR2A 1195/4885HTR2B 1055/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.