SCHEMBL3802054

SCHEMBL3802054

C[As](C)Cc1cccc(C(C)(C)CC(O)(Cc2cc3cc(C#N)ccc3[nH]2)C(F)(F)F)c1

nearest known ligand 0.58

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 20/20 0.58
NR3C2 P08235 13/20 0.58
PGR P06401 12/20 0.58
CYP3A4 P08684 5/20 0.44

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
SCHEMBL293028 0.88 NR3C1 (0.58) NR3C1NR3C2PGRCYP3A4
SCHEMBL1635555 0.86 NR3C1 (0.70) NR3C1NR3C2PGRCYP3A4
SCHEMBL1633869 0.86 NR3C1 (0.66) NR3C1NR3C2PGRCYP3A4
SCHEMBL1634915 0.84 NR3C1 (0.67) NR3C1NR3C2PGRCYP3A4
SCHEMBL293016 0.82 NR3C1 (0.55) NR3C1NR3C2PGRCYP3A4
SCHEMBL1634660 0.81 NR3C1 (0.73) NR3C1NR3C2PGRCYP3A4
SCHEMBL27754143 0.78 NR3C1 (0.58) NR3C1NR3C2PGRCYP3A4
SCHEMBL14340581 0.75 NR3C1 (0.75) NR3C1NR3C2PGRCYP3A4
SCHEMBL12762550 0.75 NR3C1 (0.53) NR3C1NR3C2PGRCYP3A4
SCHEMBL1634583 0.75 NR3C1 (0.78) NR3C1NR3C2PGRCYP3A4

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-2190431-A2 COMPOSITIONS COMPRISING A DISSOCIATED GLUCOCORTICOID RECEPTOR AGONIST FOR TREATING OR CONTROLLING ANTERIOR-SEGMENT INFLAMMATION Bausch & Lomb Incorporated (US) 2010-06-02 EP disclosed
WO-2009023471-A2 COMPOSITIONS COMPRISING A DISSOCIATED GLUCOCORTICOID RECEPTOR AGONIST FOR TREATING OR CONTROLLING ANTERIOR-SEGMENT INFLAMMATION BAUSCH & LOMB INCORPORATED (US) 2009-02-19 WO disclosed