SCHEMBL2008608

SCHEMBL2008608

C[C@@H](N)c1ccc(-c2cccnc2OC(F)F)cc1

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 3/20 0.54
PGR P06401 2/20 0.54
ALOX5AP P20292 9/20 0.45
FEN1 P39748 9/20 0.45
TRPV4 Q9HBA0 1/20 0.41
CIT O14578 1/20 0.41
FFAR4 Q5NUL3 3/20 0.40
ALK Q9UM73 1/20 0.34
PDE10A Q9Y233 1/20 0.34

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
SCHEMBL5239044 1.00 NR3C1 (0.54) NR3C1PGRALOX5APFEN1TRPV4
SCHEMBL2006463 0.84 NR3C1 (0.49) NR3C1PGRALOX5APFEN1CIT
SCHEMBL2008840 0.84 NR3C1 (0.49) NR3C1PGRALOX5APFEN1CIT
SCHEMBL2006626 0.81 PDE1A (0.43) ALOX5APFEN1CIT
SCHEMBL2007136 0.78 NR3C1 (0.50) NR3C1PGRALOX5APFEN1TRPV4
SCHEMBL2007134 0.78 NR3C1 (0.50) NR3C1PGRALOX5APFEN1TRPV4
SCHEMBL5239039 0.74 NR3C1 (0.43) NR3C1PGRALOX5APFEN1TRPV4
SCHEMBL30069219 0.73 CYP2A6 (0.46) NR3C1PGRALOX5APFEN1TRPV4
SCHEMBL29501239 0.72 ALOX5AP (0.50) NR3C1PGRALOX5APFEN1FFAR4
SCHEMBL12920023 0.71 NR3C1 (0.51) NR3C1PGRALOX5APFEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7960365-B2 Compounds with medicinal effects due to interaction with the glucocorticoid receptor N.V. ORGANON (NL) 2011-06-14 US disclosed
US-20070149577-A1 Compounds with medicinal effects due to interaction with the glucocorticoid receptor N.V. ORGANON (NL) 2007-06-28 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-20070149577-A1 Compounds with medicinal effects due to interaction with the glucocorticoid receptor NR3C1, NR3C2, MC2R NR3C1 1/4885PGR 131/4885ALOX5AP 1784/4885

“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.