SCHEMBL1142399

SCHEMBL1142399

COc1cccc(OC)c1CC(O)[C@]1(C)Cc2cnn(-c3ccc(F)cc3)c2C=C1C

nearest known ligand 0.47

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ NR3C1 P04150 9/20 0.47
▸ GLUL P15104 1/20 0.46
▸ PGR P06401 1/20 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
SCHEMBL1142284 0.84 NR3C1 (0.60) NR3C1GLULPGR
SCHEMBL1142255 0.80 NR3C1 (0.48) NR3C1GLULPGR
SCHEMBL1142251 0.80 NR3C1 (0.48) NR3C1GLULPGR
SCHEMBL1142250 0.80 NR3C1 (0.48) NR3C1GLULPGR
SCHEMBL1141737 0.79 NR3C1 (0.54) NR3C1GLULPGR
SCHEMBL4744058 0.79 NR3C1 (0.54) NR3C1GLULPGR
SCHEMBL1141733 0.79 NR3C1 (0.54) NR3C1GLULPGR
SCHEMBL1141864 0.78 NR3C1 (0.57) NR3C1PGR
SCHEMBL1141870 0.78 NR3C1 (0.57) NR3C1PGR
SCHEMBL1141869 0.78 NR3C1 (0.57) NR3C1PGR

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
US-7888381-B2 Modulators of glucocorticoid receptor, AP-1, and/or NF-κB activity, and use thereof BRISTOL-MYERS SQUIBB COMPANY (US) 2011-02-15 — — US claimed
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