SCHEMBL4448705

SCHEMBL4448705

CC(O)(Cc1cc2ccccc2[nH]1)CC(C)(c1ccc(F)cc1)C(F)(F)F

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 20/20 0.56
PGR P06401 16/20 0.56
NR3C2 P08235 15/20 0.56
CYP3A4 P08684 1/20 0.43

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
SCHEMBL5781116 0.87 NR3C1 (0.48) NR3C1PGRNR3C2CYP3A4
SCHEMBL4454490 0.84 NR3C1 (0.62) NR3C1PGRNR3C2CYP3A4
SCHEMBL291546 0.84 NR3C1 (0.70) NR3C1PGRNR3C2CYP3A4
SCHEMBL14157368 0.80 NR3C1 (0.47) NR3C1PGRNR3C2
SCHEMBL15135768 0.79 NR3C1 (0.61) NR3C1PGRNR3C2CYP3A4
SCHEMBL5255163 0.79 NR3C1 (0.74) NR3C1PGRNR3C2CYP3A4
SCHEMBL14340534 0.79 NR3C1 (0.53) NR3C1PGRNR3C2CYP3A4
SCHEMBL3657051 0.76 NR3C1 (0.79) NR3C1PGRNR3C2
SCHEMBL292601 0.75 NR3C1 (0.66) NR3C1PGRNR3C2CYP3A4
SCHEMBL1634578 0.75 NR3C1 (0.62) NR3C1PGRNR3C2CYP3A4

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
EP-2061444-A2 COMPOSITIONS AND METHODS FOR TREATING, CONTROLLING, REDUCING, AMELIORATING, OR PREVENTING ALLERGY Bausch & Lomb Incorporated (US) 2009-05-27 EP disclosed
WO-2008033655-A2 COMPOSITIONS AND METHODS FOR TREATING, CONTROLLING, REDUCING, AMELIORATING, OR PREVENTING ALLERGY BAUSCH & LOMB INCORPORATED (US) 2008-03-20 WO disclosed