SCHEMBL6650780

SCHEMBL6650780

COc1ccc2c(c1)-c1ccc3c(c1CO2)C(C)=CC(C)(C)N3

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ PGR P06401 18/20 1.00
▸ NR3C1 P04150 8/20 0.72
▸ AR P10275 7/20 0.72
▸ NR3C2 P08235 2/20 0.72

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 0.86 PGR (1.00) PGRNR3C1ARNR3C2
SCHEMBL6650765 0.84 PGR (1.00) PGRNR3C1ARNR3C2
SCHEMBL6649865 0.84 PGR (1.00) PGRNR3C1ARNR3C2
SCHEMBL5773659 0.81 PGR (1.00) PGRNR3C1ARNR3C2
SCHEMBL4169459 0.79 NR3C1 (0.72) PGRNR3C1ARNR3C2
SCHEMBL4176699 0.78 NR3C1 (1.00) PGRNR3C1ARNR3C2
SCHEMBL6648906 0.76 PGR (0.72) PGRNR3C1AR
SCHEMBL5889167 0.76 PGR (0.77) PGRNR3C1AR
SCHEMBL1322296 0.73 ALDH1A1 (0.74) PGR
SCHEMBL4176698 0.73 PGR (0.77) PGRNR3C1ARNR3C2

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
EP-1043325-B1 Steroid receptor modulator compounds and methods LIGAND PHARM INC (US) 2004-06-16 — — EP claimed
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