SCHEMBL5509544

SCHEMBL5509544

CCOc1ccccc1-c1cc(F)c(NC(=O)C2CCCC2C(=O)O)c(F)c1

nearest known ligand 0.57

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 5/20 0.57
ALDH1A1 P00352 2/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
HTT P42858 1/20 0.46
NR4A2 P43354 1/20 0.46
GLA P06280 1/20 0.44
CYP1A2 P05177 1/20 0.43
RAB9A P51151 2/20 0.43
LMNA P02545 2/20 0.43
FFAR4 Q5NUL3 1/20 0.42
KDM4E B2RXH2 1/20 0.42
TSHR P16473 1/20 0.42
RECQL P46063 1/20 0.42
HSD17B10 Q99714 1/20 0.42
DGAT2 Q96PD7 1/20 0.41
FNTA P49354 1/20 0.41
FNTB P49356 1/20 0.41

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
SCHEMBL5509546 0.86 DHODH (0.52) DHODHALDH1A1MEN1KMT2ANR4A2
SCHEMBL5509135 0.82 DHODH (0.62) DHODHALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL5514725 0.81 DHODH (0.57) DHODHALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL5512652 0.78 DHODH (0.62) DHODHALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL251960 0.77 DHODH (0.79) DHODHNR4A2
SCHEMBL7824889 0.76 KDM4E (0.62) ALDH1A1MEN1KMT2AL3MBTL1LMNA
SCHEMBL14074946 0.75 CYP2C19 (0.50) DHODHALDH1A1MEN1KMT2AHTT
SCHEMBL14074979 0.73 DHODH (0.59) DHODHALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL1124252 0.73 DHODH (1.00) DHODHALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL1124423 0.71 DHODH (1.00) DHODHALDH1A1KMT2AL3MBTL1HTT

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 1/4885ALDH1A1 517/4885MEN1 4362/4885

“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.