Fumaric Acid

Fumaric Acid

SCHEMBL5198477

Cc1ccccsc(C)c(C)c1C.O=C(O)C=CC(=O)O

nearest known ligand 0.42

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
KMT2A known ✓ Q03164 3/20 0.42
MEN1 known ✓ O00255 2/20 0.40
HCAR2 Q8TDS4 3/20 0.42
GAA P10253 3/20 0.42
MAPT P10636 4/20 0.40
RAB9A P51151 3/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
TP53 P04637 2/20 0.40
PKM P14618 1/20 0.40
NPC1 O15118 2/20 0.38
FFAR1 O14842 1/20 0.36
HDAC3 O15379 1/20 0.36
TNKS O95271 1/20 0.36
HDAC4 P56524 1/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC7 Q8WUI4 1/20 0.36
HDAC2 Q92769 1/20 0.36
HDAC10 Q969S8 1/20 0.36
HDAC11 Q96DB2 1/20 0.36
HDAC8 Q9BY41 1/20 0.36

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
Maleic Acid SCHEMBL5198470 1.00 HCAR2 (0.42) HCAR2KMT2AGAAMAPTRAB9A
Acetic Acid SCHEMBL5196852 0.88 GAA (0.40) KMT2AGAAMAPTRAB9ASMN1; SMN2
Formic Acid SCHEMBL5197972 0.84 ALDH1A1 (0.36) KMT2AGAAMAPTRAB9ASMN1; SMN2
SCHEMBL752673 0.84 TSHR (0.41) KMT2AGAAMAPTRAB9ASMN1; SMN2
Phthalic Acid SCHEMBL5198532 0.83 KMT2A (0.47) KMT2ARAB9AMEN1NPC1LMNA
Water SCHEMBL5196978 0.82 TSHR (0.39) KMT2AGAAMAPTRAB9ASMN1; SMN2
Hydrochloric Acid SCHEMBL31150435 0.82 TSHR (0.39) KMT2AGAAMAPTRAB9ASMN1; SMN2
Hydrochloric Acid SCHEMBL154108 0.82 TSHR (0.39) KMT2AGAAMAPTRAB9ASMN1; SMN2
Sulfuric Acid SCHEMBL2110043 0.81 GAA (0.36) KMT2AGAAMAPTRAB9ASMN1; SMN2
Hydrochloric Acid SCHEMBL3327763 0.80 TSHR (0.38) KMT2AGAAMAPTRAB9ASMN1; SMN2

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7220879-B2 Method for inhibiting polymerization of (meth)acrylic acid and its esters using an inhibitor and a process for making a compound useful as such an inhibitor ROHM AND HAAS COMPANY (US) 2007-05-22 US claimed
EP-1647543-B1 A method for inhibiting polymerization of (Meth) acrylic acid and its esters using an inhibitor and a process for making a compound useful as such an inhibitor ROHM & HAAS (US) 2007-05-02 EP claimed
EP-1647543-A1 A method for inhibiting polymerization of (Meth) acrylic acid and its esters using an inhibitor and a process for making a compound useful as such an inhibitor Rohm and Haas Company (US) 2006-04-19 EP claimed
US-20060074257-A1 Method for inhibiting polymerization of (meth)acrylic acid and its esters using an inhibitor and a process for making a compound useful as such an inhibitor BASS STEPHEN 2006-04-06 US claimed
US-20070197785-A1 METHOD FOR INHIBITING POLYMERIZATION OF (METH) ACRYLIC ACID AND ITS ESTERS USING AN INHIBITOR AND A PROCESS FOR MAKING A COMPOUND USEFUL AS SUCH AN INHIBITOR BASS STEPHEN 2007-08-23 US disclosed
US-7253279-B1 Method for inhibiting polymerization of (METH) acrylic acid and its esters using an inhibitor and a process for making a compound useful as such an inhibitor ROHM AND HAAS COMPANY (US) 2007-08-07 US disclosed
US-7220879-B2 Method for inhibiting polymerization of (meth)acrylic acid and its esters using an inhibitor and a process for making a compound useful as such an inhibitor ROHM AND HAAS COMPANY (US) 2007-05-22 US disclosed
EP-1647543-B1 A method for inhibiting polymerization of (Meth) acrylic acid and its esters using an inhibitor and a process for making a compound useful as such an inhibitor ROHM & HAAS (US) 2007-05-02 EP disclosed
EP-1647543-A1 A method for inhibiting polymerization of (Meth) acrylic acid and its esters using an inhibitor and a process for making a compound useful as such an inhibitor Rohm and Haas Company (US) 2006-04-19 EP disclosed
US-20060074257-A1 Method for inhibiting polymerization of (meth)acrylic acid and its esters using an inhibitor and a process for making a compound useful as such an inhibitor BASS STEPHEN 2006-04-06 US 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-20070197785-A1 METHOD FOR INHIBITING POLYMERIZATION OF (METH) ACRYLIC ACID AND ITS ESTERS USING AN INHIBITOR AND A PROCESS FOR MAKING A COMPOUND USEFUL AS SUCH AN INHIBITOR MMAB, AZI2, MEP1A KMT2A 421/4885MEN1 2242/4885HCAR2 365/4885
US-20060074257-A1 Method for inhibiting polymerization of (meth)acrylic acid and its esters using an inhibitor and a process for making a compound useful as such an inhibitor MMAB, AZI2, MEP1A KMT2A 421/4885MEN1 2242/4885HCAR2 365/4885

“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.