SCHEMBL5511052

SCHEMBL5511052

COc1cccc(-c2ccc(NC(=O)[C@H]3CCC[C@H]3C(=O)O)c(F)c2)c1

nearest known ligand 0.60

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 13/20 0.60
NR4A2 P43354 4/20 0.60
JMJD7 P0C870 1/20 0.60
NR4A1 P22736 1/20 0.60
NR4A3 Q92570 1/20 0.60
NR1H4 Q96RI1 1/20 0.60
DGAT1 O75907 2/20 0.59
HTT P42858 1/20 0.58
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
NPSR1 Q6W5P4 1/20 0.56
ALDH1A1 P00352 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
GLA P06280 1/20 0.50

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
SCHEMBL5516857 1.00 DHODH (0.60) DHODHNR4A2JMJD7NR4A1NR4A3
SCHEMBL14422942 0.88 DHODH (0.62) DHODHNR4A2JMJD7NR4A1NR4A3
SCHEMBL5511055 0.86 DHODH (0.54) DHODHNR4A2JMJD7NR4A1NR4A3
SCHEMBL19417215 0.85 HTT (0.71) DGAT1HTTMEN1KMT2AALDH1A1
SCHEMBL14422943 0.85 DHODH (0.59) DHODHNR4A2JMJD7NR4A1NR4A3
SCHEMBL14452173 0.83 HTT (0.58) DHODHNR4A2DGAT1HTTMEN1
SCHEMBL6223427 0.78 DHODH (0.59) DHODHNR4A2JMJD7NR4A1NR4A3
SCHEMBL5509135 0.77 DHODH (0.62) DHODHNR4A2MEN1KMT2AALDH1A1
SCHEMBL13370806 0.76 DHODH (0.54) DHODHNR4A2JMJD7NR4A1NR4A3
SCHEMBL5515802 0.76 DHODH (0.61) DHODHNR4A2DGAT1HTTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070224672-A1 Method of Identifying Inhibitors of DHODH LEBAN JOHANN 2007-09-27 US disclosed
US-7247736-B2 Method of identifying inhibitors of DHODH 4SC AG (DE) 2007-07-24 US disclosed
US-20070027193-A1 Method of identifying inhibitors of DHODH 4SC AG (DE) 2007-02-01 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 (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-20070027193-A1 Method of identifying inhibitors of DHODH DHODH, SQOR, NDUFA5 DHODH 1/4885NR4A2 2196/4885JMJD7 2100/4885

“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.