SCHEMBL29868614

SCHEMBL29868614

[2H]C([2H])([2H])Oc1cccc(-c2cc(F)c(NC(=O)C3=C(C(=O)O)CCC3)c(F)c2)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 19/20 1.00
NR4A2 P43354 12/20 1.00
JMJD7 P0C870 1/20 0.68
NR4A1 P22736 1/20 0.68
NR4A3 Q92570 1/20 0.68
NR1H4 Q96RI1 1/20 0.68

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
SCHEMBL31125355 0.93 DHODH (1.00) DHODHNR4A2JMJD7NR4A1NR4A3
Vidofludimus SCHEMBL29869156 0.89 DHODH (1.00) DHODHNR4A2JMJD7NR4A1NR4A3
SCHEMBL29868321 0.89 DHODH (1.00) DHODHNR4A2
SCHEMBL29868737 0.88 DHODH (1.00) DHODHNR4A2
SCHEMBL31026699 0.87 DHODH (0.81) DHODHNR4A2JMJD7NR4A1NR4A3
Vidofludimus SCHEMBL29868416 0.87 DHODH (0.85) DHODHNR4A2JMJD7NR4A1NR4A3
SCHEMBL31326982 0.86 DHODH (0.81) DHODHNR4A2JMJD7NR4A1NR4A3
SCHEMBL502818 0.85 DHODH (1.00) DHODHNR4A2JMJD7NR4A1NR4A3
SCHEMBL249081 0.84 DHODH (1.00) DHODHNR4A2JMJD7NR4A1NR4A3
SCHEMBL31244586 0.84 DHODH (1.00) DHODHNR4A2JMJD7NR4A1NR4A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250032527-A1 MEDICAL USE OF N4-HYDROXY CITICOLINE COMPOUNDS IMMUNIC AG (DE) 2025-01-30 US disclosed
EP-4426315-A1 MEDICAL USE OF N4-HYDROXY CITICOLINE COMPOUNDS Immunic AG (DE) 2024-09-11 EP disclosed
CN-118382610-A DHODH inhibitors containing carboxylic acid bioisosteres 埃慕尼克股份公司 2024-07-23 CN disclosed
EP-4320100-A1 DEUTERATED DHODH INHIBITORS Immunic AG (DE) 2024-02-14 EP disclosed
WO-2023073239-A1 MEDICAL USE OF N4-HYDROXY CITICOLINE COMPOUNDS IMMUNIC AG (DE) 2023-05-04 WO disclosed
WO-2022214691-A1 DEUTERATED DHODH INHIBITORS IMMUNIC AG (DE) 2022-10-13 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-20250032527-A1 MEDICAL USE OF N4-HYDROXY CITICOLINE COMPOUNDS SLC5A7, HCRTR1, SPHK1 DHODH 717/4885NR4A2 2354/4885JMJD7 2359/4885

“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.