SCHEMBL9987883

SCHEMBL9987883

COc1cc(F)ccc1C(C)(C)CC(N)(Cc1cc(C)cc(C)n1)C(F)(F)F

nearest known ligand 0.46

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 19/20 0.46
NR3C2 P08235 11/20 0.46
CYP3A4 P08684 1/20 0.42
PGR P06401 5/20 0.40

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
SCHEMBL294042 0.92 NR3C1 (0.56) NR3C1NR3C2CYP3A4PGR
SCHEMBL9987879 0.80 NR3C1 (0.34) NR3C1NR3C2CYP3A4PGR
SCHEMBL1633458 0.78 NR3C1 (0.72) NR3C1NR3C2CYP3A4PGR
SCHEMBL293313 0.78 NR3C1 (0.59) NR3C1NR3C2CYP3A4PGR
SCHEMBL5389089 0.76 NR3C1 (0.73) NR3C1NR3C2PGR
SCHEMBL1634899 0.75 NR3C1 (0.62) NR3C1NR3C2CYP3A4PGR
SCHEMBL292058 0.74 NR3C1 (0.67) NR3C1NR3C2CYP3A4PGR
SCHEMBL13823473 0.73 NR3C1 (0.56) NR3C1NR3C2CYP3A4PGR
SCHEMBL292356 0.72 NR3C1 (0.54) NR3C1NR3C2PGR
SCHEMBL5394448 0.71 NR3C1 (0.76) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2397140-A1 Compositions and methods for treating or preventing glaucoma or progression thereof BAUSCH & LOMB INCORPORATED (US) 2011-12-21 EP disclosed