SCHEMBL8806501

SCHEMBL8806501

CCCC[C@H]1Oc2ccccc2-c2ccc3c(c21)C(C)=CC(C)(C)N3

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ PGR P06401 19/20 1.00
▸ NR3C1 P04150 12/20 1.00
▸ AR P10275 9/20 1.00
▸ ESR1 P03372 3/20 0.64
▸ NR3C2 P08235 3/20 0.64
▸ ESR2 Q92731 3/20 0.64

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
SCHEMBL8806499 1.00 PGR (1.00) PGRNR3C1ARESR1NR3C2
SCHEMBL8806388 0.94 PGR (0.88) PGRNR3C1ARESR1NR3C2
SCHEMBL8808541 0.86 PGR (1.00) PGRNR3C1ARESR1NR3C2
SCHEMBL4176522 0.84 NR3C1 (1.00) PGRNR3C1AR
SCHEMBL8141286 0.83 NR3C1 (1.00) PGRNR3C1AR
SCHEMBL8148258 0.81 PGR (1.00) PGRNR3C1ARESR1NR3C2
SCHEMBL6294344 0.80 NR3C1 (0.74) PGRNR3C1AR
SCHEMBL4176184 0.79 NR3C1 (0.75) PGRNR3C1AR
SCHEMBL5355526 0.79 PGR (0.75) PGRNR3C1ARNR3C2
SCHEMBL4170287 0.78 NR3C1 (0.89) PGRNR3C1AR

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
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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