SCHEMBL986328

SCHEMBL986328

O=C(Nc1ccc(-c2ccno2)cc1)C(O)(CC1(c2ccccc2C(F)(F)F)CCC1)C(F)(F)F

nearest known ligand 0.40

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 16/20 0.40
EPHX2 P34913 1/20 0.39
POLB P06746 1/20 0.38
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36

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
SCHEMBL983406 0.84 EPHX2 (0.38) NR3C1EPHX2MEN1KMT2A
SCHEMBL985083 0.83 NR3C1 (0.44) NR3C1EPHX2
SCHEMBL4969666 0.83 EPHX2 (0.41) EPHX2POLBMEN1KMT2A
SCHEMBL984371 0.77 RHOA (0.42) NR3C1
SCHEMBL5644235 0.76 NR3C1 (0.69) NR3C1
SCHEMBL983364 0.76 NR3C1 (0.44) NR3C1POLB
SCHEMBL984006 0.76 NR3C1 (0.39) NR3C1EPHX2
SCHEMBL15047780 0.76 NR3C1 (0.39) NR3C1EPHX2MEN1KMT2A
SCHEMBL7167931 0.75 NR3C1 (0.67) NR3C1
SCHEMBL5644049 0.74 NR3C1 (0.68) NR3C1

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
EP-1960351-B1 PROPIONAMIDE COMPOUNDS AS ANTIINFLAMMATORY AGENTS HOFFMANN LA ROCHE (CH) 2013-06-19 EP claimed
US-7868031-B2 Propionamide compounds as antiinflammatory agents ROCHE PALO ALTO LLC (US) 2011-01-11 US claimed
US-20070135500-A1 Propionamide compounds as antiinflammatory agents ROCHE PALO ALTO LLC 2007-06-14 US claimed

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-20070135500-A1 Propionamide compounds as antiinflammatory agents PTGS1, PTGER1, PTGES3 NR3C1 707/4885EPHX2 625/4885POLB 2718/4885

“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.