Fumaric Acid

Fumaric Acid

SCHEMBL29772229

CC(C)[Si]1(C(C)C)OC[C@H]2O[C@@H](n3cnc4c(NC(=O)c5ccccc5)ncnc43)[C@H](OCOCCOCCN)[C@@H]2O[Si](C(C)C)(C(C)C)O1.O=C(O)/C=C/C(=O)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

ADRB1ADRB2ATP4AATP4BAXLCHRM2CHRM3DRD2FLT3HRH1HTR2AHTR2BHTR2CKCNH2KMT2AMAP2K1MAP2K2MEN1MLNRPLK4RENS1PR1SLC6A2SLC6A4atpAatpBatpCatpDatpEatpFatpFHatpGpol

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 17)

geneUniProtsupporting neighboursconfidence
▸ PRMT6 Q96LA8 1/20 0.41
▸ CYP1A2 P05177 1/20 0.36
▸ HTR1A P08908 1/20 0.36
▸ CYP2D6 P10635 1/20 0.36
▸ ADRB3 P13945 1/20 0.36
▸ PDE4A P27815 1/20 0.36
▸ PTGS2 P35354 1/20 0.36
▸ PDE4D Q08499 1/20 0.36
▸ PDE3A Q14432 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ RXFP1 Q9HBX9 1/20 0.36
▸ P2RY12 Q9H244 5/20 0.35
▸ ADORA2A P29274 2/20 0.34
▸ ADORA2B P29275 2/20 0.34
▸ STING1 Q86WV6 1/20 0.34

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
SCHEMBL26238542 0.97 PRMT6 (0.43) PRMT6CYP1A2HTR1ACYP2D6ADRB3
SCHEMBL23042726 0.97 PRMT6 (0.43) PRMT6CYP1A2HTR1ACYP2D6ADRB3
SCHEMBL29772226 0.97 PRMT6 (0.43) PRMT6CYP1A2HTR1ACYP2D6ADRB3
SCHEMBL29827355 0.91 PRMT6 (0.41) PRMT6CYP1A2HTR1ACYP2D6ADRB3
SCHEMBL23042587 0.90 PRMT6 (0.40) PRMT6CYP1A2HTR1ACYP2D6ADRB3
SCHEMBL30773491 0.89 PRMT6 (0.40) PRMT6CYP1A2HTR1ACYP2D6ADRB3
SCHEMBL19509819 0.88 PRMT6 (0.38) PRMT6CYP1A2HTR1ACYP2D6ADRB3
SCHEMBL19500433 0.88 PRMT6 (0.38) PRMT6CYP1A2HTR1ACYP2D6ADRB3
SCHEMBL21652380 0.88 PRMT6 (0.38) PRMT6CYP1A2HTR1ACYP2D6ADRB3
SCHEMBL19500432 0.88 PRMT6 (0.38) PRMT6CYP1A2HTR1ACYP2D6ADRB3

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
US-20220306679-A1 LIGAND-2'-MODIFIED NUCLEIC ACIDS, SYNTHESIS THEREOF AND INTERMEDIATE COMPOUNDS THEREOF DICERNA PHARMACEUTICALS, INC. 2022-09-29 — — US disclosed
EP-4021915-A1 LIGAND-2'-MODIFIED NUCLEIC ACIDS, SYNTHESIS THEREOF AND INTERMEDIATE COMPOUNDS THEREOF Dicerna Pharmaceuticals, Inc. (US) 2022-07-06 — — EP 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-20220306679-A1 LIGAND-2'-MODIFIED NUCLEIC ACIDS, SYNTHESIS THEREOF AND INTERMEDIATE COMPOUNDS THEREOF NSUN2, NSUN3, AGO2 PRMT6 1017/4885CYP1A2 4244/4885HTR1A 4497/4885

“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.

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