SCHEMBL6649865

SCHEMBL6649865

CC1=CC(C)(C)Nc2ccc3c(c21)COc1ccc(F)cc1-3

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ PGR P06401 19/20 1.00
▸ AR P10275 10/20 1.00
▸ NR3C2 P08235 2/20 1.00
▸ NR3C1 P04150 8/20 0.76

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
SCHEMBL6651912 0.88 PGR (1.00) PGRARNR3C2NR3C1
SCHEMBL6650765 0.86 PGR (1.00) PGRARNR3C2NR3C1
SCHEMBL6650780 0.84 PGR (1.00) PGRARNR3C2NR3C1
SCHEMBL5773659 0.83 PGR (1.00) PGRARNR3C2NR3C1
SCHEMBL14139076 0.76 PGR (0.61) PGRARNR3C2NR3C1
SCHEMBL14138787 0.75 PGR (0.60) PGRARNR3C2NR3C1
SCHEMBL4176699 0.75 NR3C1 (1.00) PGRARNR3C2NR3C1
SCHEMBL6648084 0.75 PGR (0.78) PGRARNR3C2NR3C1
SCHEMBL4169459 0.74 NR3C1 (0.72) PGRARNR3C2NR3C1
SCHEMBL14138797 0.74 PGR (0.59) PGRARNR3C2NR3C1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1043325-B1 Steroid receptor modulator compounds and methods LIGAND PHARM INC (US) 2004-06-16 — — EP claimed
EP-0800519-A1 STEROID RECEPTOR MODULATOR COMPOUNDS AND METHODS LIGAND PHARMACEUTICALS, INC. (US) 1997-10-15 — — EP disclosed
WO-1996019458-A2 STEROID RECEPTOR MODULATOR COMPOUNDS AND METHODS LIGAND PHARMACEUTICALS INCORPORATED (US) 1996-06-27 — — WO disclosed
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