SCHEMBL5744285

SCHEMBL5744285

Cc1cc(C)cc(NC(=O)C(O)(CC2CCCCC2)CC(C)(C)c2cc(F)ccc2O)c1

nearest known ligand 0.68

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 15/20 0.68
PGR P06401 12/20 0.68
NR3C2 P08235 8/20 0.68
AR P10275 1/20 0.42
NPC1 O15118 2/20 0.39
RAB9A P51151 1/20 0.39
GAA P10253 1/20 0.38
PKM P14618 1/20 0.38
HTT P42858 1/20 0.38
LMNA P02545 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
RORC P51449 1/20 0.35

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
SCHEMBL5742193 0.91 NR3C1 (0.69) NR3C1PGRNR3C2ARNPC1
SCHEMBL5744672 0.90 NR3C1 (0.67) NR3C1PGRNR3C2ARNPC1
SCHEMBL4619251 0.90 NR3C1 (0.72) NR3C1PGRNR3C2AR
SCHEMBL5742841 0.89 NR3C1 (0.66) NR3C1PGRNR3C2ARRAB9A
SCHEMBL6326838 0.88 NR3C1 (0.55) NR3C1PGRNR3C2AR
SCHEMBL4137958 0.83 NR3C1 (0.60) NR3C1PGRNR3C2ARNPC1
SCHEMBL4616683 0.82 NR3C1 (0.58) NR3C1PGRNR3C2AR
SCHEMBL293071 0.81 PGR (1.00) NR3C1PGRNR3C2
SCHEMBL292196 0.81 NR3C1 (1.00) NR3C1PGRNR3C2AR
SCHEMBL5744371 0.81 NR3C1 (0.68) 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-1467982-B1 GLUCOCORTICOID MIMETICS, METHODS OF MAKING THEM, PHARMACEUTICAL FORMULATIONS CONTAINING THEM, AND USES THEREOF BOEHRINGER INGELHEIM PHARMA (US) 2006-11-22 EP claimed
US-7189758-B2 Glucocorticoid mimetics, methods of making them, pharmaceutical formulations, and uses thereof BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2007-03-13 US disclosed
US-7189758-B2 Glucocorticoid mimetics, methods of making them, pharmaceutical formulations, and uses thereof BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2007-03-13 US disclosed
US-6960581-B2 Glucocorticoid mimetics, methods of making them, pharmaceutical formulations, and uses thereof BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2005-11-01 US disclosed