SCHEMBL4446013

SCHEMBL4446013

COc1ccc(F)cc1C(C)(CC(C)(O)Cc1cc2cnccc2[nH]1)C(F)F

nearest known ligand 0.71

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 20/20 0.71
NR3C2 P08235 15/20 0.71
PGR P06401 8/20 0.71

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
SCHEMBL3687823 0.86 NR3C1 (0.78) NR3C1NR3C2PGR
SCHEMBL293361 0.85 NR3C1 (0.78) NR3C1NR3C2PGR
SCHEMBL290538 0.83 NR3C1 (1.00) NR3C1NR3C2PGR
SCHEMBL3688034 0.83 NR3C1 (0.67) NR3C1NR3C2PGR
SCHEMBL292978 0.82 NR3C1 (1.00) NR3C1NR3C2PGR
SCHEMBL292716 0.82 NR3C1 (0.86) NR3C1NR3C2PGR
SCHEMBL1932505 0.81 NR3C1 (0.71) NR3C1NR3C2PGR
SCHEMBL293186 0.81 NR3C1 (1.00) NR3C1NR3C2PGR
SCHEMBL3659894 0.80 NR3C1 (0.70) NR3C1NR3C2PGR
SCHEMBL3651745 0.79 NR3C1 (0.81) NR3C1NR3C2PGR

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