SCHEMBL5515410

SCHEMBL5515410

O=C(O)C1CCCC1C(=O)Nc1c(F)c(F)c(-c2cccc(OC(F)(F)F)c2)c(F)c1F

nearest known ligand 0.62

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 11/20 0.62
DHFR P00374 2/20 0.52
DGAT1 O75907 1/20 0.42
FNTA P49354 1/20 0.42
FNTB P49356 1/20 0.42
SCN9A Q15858 2/20 0.42
LMNA P02545 1/20 0.42
RAB9A P51151 1/20 0.42
MEN1 O00255 1/20 0.41
ALDH1A1 P00352 1/20 0.41
KMT2A Q03164 1/20 0.41
L3MBTL1 Q9Y468 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
SCHEMBL5515802 0.87 DHODH (0.61) DHODHDGAT1FNTAFNTBSCN9A
SCHEMBL14422942 0.82 DHODH (0.62) DHODHDGAT1MEN1ALDH1A1KMT2A
SCHEMBL20673116 0.77 DHODH (0.64) DHODHDHFR
SCHEMBL517489 0.76 DHODH (1.00) DHODHDHFR
SCHEMBL4399438 0.76 DHODH (0.74) DHODHDHFR
SCHEMBL299773 0.75 DHODH (0.72) DHODHDHFR
SCHEMBL299933 0.73 DHODH (1.00) DHODHDHFR
SCHEMBL31326983 0.73 DHODH (0.83) DHODHDHFR
SCHEMBL25839308 0.73 DHODH (0.83) DHODHDHFR
SCHEMBL21067790 0.72 DHODH (0.63) DHODHDHFR

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-20070224672-A1 Method of Identifying Inhibitors of DHODH LEBAN JOHANN 2007-09-27 US disclosed
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
EP-1581478-A1 DHODH-INHIBITORS AND METHOD FOR THEIR IDENTIFICATION 4SC AG (DE) 2005-10-05 EP disclosed
WO-2004056747-A1 DHODH-INHIBITORS AND METHOD FOR THEIR IDENTIFICATION 4SC AG (DE) 2004-07-08 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-20070027193-A1 Method of identifying inhibitors of DHODH DHODH, SQOR, NDUFA5 DHODH 1/4885DHFR 67/4885DGAT1 2193/4885

“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.