Fumaric Acid

Fumaric Acid

SCHEMBL2908209

CN(C)C(N)=Nc1ccccc1N1CCOCC1.O=C(O)C=CC(=O)O

nearest known ligand 0.40

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 20)

geneUniProtsupporting neighboursconfidence
MEN1 known ✓ O00255 2/20 0.37
KMT2A known ✓ Q03164 2/20 0.37
POLB P06746 3/20 0.40
GAA P10253 3/20 0.40
MAPT P10636 3/20 0.40
NAPEPLD Q6IQ20 1/20 0.39
NPC1 O15118 3/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
AKR1C3 P42330 1/20 0.38
ALDH1A1 P00352 7/20 0.38
KDM4E B2RXH2 2/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C19 P33261 1/20 0.38
L3MBTL1 Q9Y468 3/20 0.38
RAB9A P51151 2/20 0.38
RECQL P46063 1/20 0.38
KCNQ2 O43526 1/20 0.37
PKM P14618 1/20 0.37
TDP1 Q9NUW8 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
Fumaric Acid SCHEMBL4968361 1.00 POLB (0.40) POLBGAAMAPTNAPEPLDNPC1
Fumaric Acid SCHEMBL2908206 1.00 POLB (0.40) POLBGAAMAPTNAPEPLDNPC1
SCHEMBL2707104 0.90 SIGMAR1 (0.40) POLBGAAMAPTNPC1SMN1; SMN2
SCHEMBL6553147 0.90 SIGMAR1 (0.40) POLBGAAMAPTNPC1SMN1; SMN2
Hydrochloric Acid SCHEMBL9424101 0.89 SIGMAR1 (0.39) POLBGAAMAPTNPC1SMN1; SMN2
Hydrochloric Acid SCHEMBL9424098 0.89 SIGMAR1 (0.39) POLBGAAMAPTNPC1SMN1; SMN2
Fumaric Acid SCHEMBL17078223 0.84 POLB (0.39) POLBGAAMAPTNPC1SMN1; SMN2
Fumaric Acid SCHEMBL6139704 0.81 LMNA (0.43) POLBGAAMAPTNAPEPLDNPC1
Fumaric Acid SCHEMBL6139699 0.81 LMNA (0.43) POLBGAAMAPTNAPEPLDNPC1
SCHEMBL8423965 0.80 ALDH1A1 (0.40) POLBGAAMAPTNAPEPLDNPC1

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 105 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040077730-A1 Carbocyclic halo amines such as N,N-dimethyl-1-(1-(4-chloro-phenyl)cyclobutyl)-3-methylbutyl amine hydrochloride, used for reducing insulin resistance in humans having diabetes BAILEY CLIFFORD JAMES (GB) 2004-04-22 US claimed
EP-0946181-B1 USE OF 2-(2-MORPHOLINOPHENYL) GUANIDINE DERIVATIVES FOR THE TREATMENT OF DIABETES COMPLICATIONS KNOLL GMBH (DE) 2004-02-25 EP claimed
US-6617360-B1 Arylcyclobutylalkylamines, especially sibutramine; and a an oral insulin secretagogue such as 1,1-dimethyl-2-(2-morpholinophenyl)guanidine fumarate or a sulfonyl urea, or an insulin sensitizer KNOLL AKTIENGESELLSCHAFT (DE) 2003-09-09 US claimed
US-6133267-A Use of 2-(2-morpholinophenyl) guanidine derivatives for the treatment of diabetes complications KNOLL AKTIENGESELLSCHAFT (DE) 2000-10-17 US claimed
US-11331379-B2 Compositions and methods for regulating pancreatic beta cell function using adipsin DANA-FARBER CANCER INSTITUTE, INC. (US) 2022-05-17 US disclosed
US-20200093900-A1 COMPOSITIONS AND METHODS FOR REGULATING PANCREATIC BETA CELL FUNCTION USING ADIPSIN DANA-FARBER CANCER INSTITUTE, INC. 2020-03-26 US disclosed
US-10328131-B2 Compositions and methods for regulating pancreatic beta cell function using adipsin DANA-FARBER CANCER INSTITUTE, INC. (US) 2019-06-25 US disclosed
US-20170072028-A1 COMPOSITIONS AND METHODS FOR REGULATING PANCREATIC BETA CELL FUNCTION USING ADIPSIN DANA-FARBER CANCER INSTITUTE, INC. 2017-03-16 US disclosed
EP-1509545-B1 HOMOTRIMERIC EXTENDED OBG3 GLOBULAR HEAD AND USES THEREOF SERONO GENETICS INST SA (FR) 2010-08-25 EP disclosed
US-7671024-B2 OBG3 globular head and uses thereof SERONO GENETICS INSTITUTE S.A. (FR) 2010-03-02 US disclosed
US-20090099076-A1 OBG3 Globular Head and Uses Thereof SERONO GENETICS INSTITUTE S.A. (FR) 2009-04-16 US disclosed
US-7459433-B2 Homotrimeric extended OBG3 globular head and uses thereof SERONO GENETICS INSTITUTE, S.A. (FR) 2008-12-02 US disclosed
US-20020091080-A1 OBG3 globular head and uses thereof for decreasing body mass SERONO GENETICS INSTITUTE S.A. (FR) 2002-07-11 US disclosed
US-20020037849-A1 OBG3 globular head and uses thereof for decreasing body mass SERONO GENETICS INSTITUTE S.A. (FR) 2002-03-28 US disclosed
US-6174925-B1 REDUCING INSULIN RESISTANCE IN HUMANS IN WHOM IMPAIRED GLUCOSE TOLERANCE OR NON-INSULIN DEPENDENT DIABETES MELLITUS HAVE NOT PRESENTED BUT IN WHOM THERE IS INCREASED RISK OF DEVELOPING SUCH CONDITIONS BY ADMINISTERING SIBUTRAMINE ANALOGUE KNOLL AKTIENGESELLSCHAFT (DE) 2001-01-16 US disclosed
US-6133267-A Use of 2-(2-morpholinophenyl) guanidine derivatives for the treatment of diabetes complications KNOLL AKTIENGESELLSCHAFT (DE) 2000-10-17 US disclosed
EP-0946181-A1 USE OF 2-(2-MORPHOLINOPHENYL) GUANIDINE DERIVATIVES FOR THE TREATMENT OF DIABETES COMPLICATIONS KNOLL AKTIENGESELLSCHAFT (DE) 1999-10-06 EP disclosed
EP-0927028-A1 USE OF SIBUTRAMINE ANALOGUES TO PREVENT THE DEVELOPMENT OF DIABETES KNOLL AKTIENGESELLSCHAFT (DE) 1999-07-07 EP disclosed
WO-1998026782-A1 USE OF 2-(2-MORPHOLINOPHENYL) GUANIDINE DERIVATIVES FOR THE TREATMENT OF DIABETES COMPLICATIONS KNOLL AKTIENGESELLSCHAFT (DE) 1998-06-25 WO disclosed
WO-1998011884-A1 USE OF SIBUTRAMINE ANALOGUES TO PREVENT THE DEVELOPMENT OF DIABETES KNOLL AKTIENGESELLSCHAFT (DE) 1998-03-26 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 (1 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-20040077730-A1 Carbocyclic halo amines such as N,N-dimethyl-1-(1-(4-chloro-phenyl)cyclobutyl)-3-methylbutyl amine hydrochloride, used for reducing insulin resistance in humans having diabetes GPR119, CLIC1, SLC5A1 MEN1 274/4885KMT2A 1204/4885POLB 452/4885

“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.