SCHEMBL6554140

SCHEMBL6554140

COc1ccc(C(C)C)cc1C(C)(C)CC(O)(C(=O)Nc1ccc2c(c1)COC2=O)C(F)(F)F

nearest known ligand 0.81

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 19/20 0.81
PGR P06401 19/20 0.81
NR3C2 P08235 10/20 0.65
AR P10275 1/20 0.50
IMPDH2 P12268 1/20 0.45

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
SCHEMBL6583624 0.89 NR3C1 (0.84) NR3C1PGRNR3C2ARIMPDH2
SCHEMBL27480909 0.89 PGR (0.80) NR3C1PGRNR3C2AR
SCHEMBL6585107 0.89 NR3C1 (1.00) NR3C1PGRNR3C2AR
SCHEMBL6583567 0.89 NR3C1 (0.83) NR3C1PGRNR3C2ARIMPDH2
SCHEMBL6555539 0.88 PGR (0.85) NR3C1PGRNR3C2AR
SCHEMBL6554414 0.86 PGR (0.79) NR3C1PGRNR3C2AR
SCHEMBL27497818 0.84 NR3C1 (0.87) NR3C1PGRNR3C2AR
SCHEMBL27497504 0.84 PGR (0.76) NR3C1PGRNR3C2AR
SCHEMBL27482071 0.84 NR3C1 (0.84) NR3C1PGRNR3C2AR
SCHEMBL27481702 0.84 PGR (0.75) NR3C1PGRNR3C2AR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1133486-B1 NONSTEROIDAL ANTIINFLAMMATORIES SCHERING AG (DE) 2004-12-22 EP claimed
US-6323199-B1 AROMATIC HETEROCYCLIC HYDROXY AMINES OR AMIDES FOR TREATMENT OF INFLAMMATION SCHERING AKTIENGESELLSCHAFT (DE) 2001-11-27 US claimed
EP-1133486-B1 NONSTEROIDAL ANTIINFLAMMATORIES SCHERING AG (DE) 2004-12-22 EP disclosed
US-6323199-B1 AROMATIC HETEROCYCLIC HYDROXY AMINES OR AMIDES FOR TREATMENT OF INFLAMMATION SCHERING AKTIENGESELLSCHAFT (DE) 2001-11-27 US disclosed