Sugi Predict

Sugi Predict / Compounds / SCHEMBL6650300

SCHEMBL6650300

SCHEMBL6650300

CC1=CC(C)(C)Nc2ccc3c(c21)C(c1cccc(C(F)(F)F)c1)Oc1ccccc1-3

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ PGR P06401 20/20 1.00
▸ NR3C1 P04150 13/20 1.00
▸ AR P10275 13/20 1.00
▸ NR3C2 P08235 12/20 1.00
▸ ESR1 P03372 10/20 1.00
▸ ESR2 Q92731 10/20 1.00

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
SCHEMBL6648200 1.00 PGR (1.00) PGRNR3C1ARNR3C2ESR1
SCHEMBL8146749 0.88 PGR (0.82) PGRNR3C1ARNR3C2ESR1
SCHEMBL4174632 0.86 NR3C1 (1.00) PGRNR3C1ARNR3C2ESR1
SCHEMBL8015600 0.83 PGR (1.00) PGRNR3C1ARNR3C2ESR1
SCHEMBL5354748 0.83 PGR (0.76) PGRNR3C1ARNR3C2ESR1
SCHEMBL6294949 0.83 PGR (0.74) PGRNR3C1ARNR3C2ESR1
SCHEMBL7092892 0.83 PGR (1.00) PGRNR3C1ARNR3C2ESR1
SCHEMBL6648377 0.83 PGR (1.00) PGRNR3C1ARNR3C2ESR1
SCHEMBL4174214 0.82 NR3C1 (0.80) PGRNR3C1ARNR3C2ESR1
SCHEMBL6650996 0.81 PGR (1.00) PGRNR3C1ARNR3C2ESR1

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-1043325-B1 Steroid receptor modulator compounds and methods LIGAND PHARM INC (US) 2004-06-16 — — EP disclosed
EP-1041066-A1 Steroid receptor modulator compounds and methods LIGAND PHARMACEUTICALS INCORPORATED (US) 2000-10-04 — — EP disclosed
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