SCHEMBL4025376

SCHEMBL4025376

CC1(C)CC(=O)c2c(cc(F)c(Br)c2F)N1

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ NR3C1 P04150 9/20 0.34
▸ FFAR4 Q5NUL3 1/20 0.33
▸ PGR P06401 4/20 0.31
▸ NR3C2 P08235 3/20 0.31
▸ AR P10275 3/20 0.31
▸ HTT P42858 1/20 0.30
▸ ALPL P05186 1/20 0.30

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
SCHEMBL23647996 0.72 HTT (0.38) NR3C1FFAR4PGRNR3C2AR
SCHEMBL29968056 0.72 HTT (0.38) NR3C1FFAR4PGRNR3C2AR
SCHEMBL4188060 0.71 NR3C1 (0.35) NR3C1PGRNR3C2AR
SCHEMBL23647924 0.69 NR3C1 (0.35) NR3C1PGRHTT
SCHEMBL28398651 0.68 CES1 (0.44) —
SCHEMBL11175076 0.68 ALDH1A1 (0.51) NR3C1PGRHTT
SCHEMBL4196455 0.68 NR3C1 (0.69) NR3C1PGRNR3C2AR
SCHEMBL4200585 0.67 NR3C1 (0.69) NR3C1PGRNR3C2AR
SCHEMBL21624088 0.66 MOGAT2 (0.33) —
SCHEMBL29968384 0.66 MOGAT2 (0.33) —

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
WO-2009103007-A2 STEROID HORMONE RECEPTOR MODULATOR COMPOUNDS AND METHODS LIGAND PHARMACEUTICALS INCORPORATED (US) 2009-08-20 — — WO disclosed
WO-2009103007-A2 STEROID HORMONE RECEPTOR MODULATOR COMPOUNDS AND METHODS LIGAND PHARMACEUTICALS INCORPORATED (US) 2009-08-20 — — WO disclosed
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