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SCHEMBL7953151

SCHEMBL7953151

CC1=CC(C)(C)Nc2ccc3c(c21)C(c1cccc(Cl)c1)Oc1ccc(F)cc1-3

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 6/20 1.00
▸ AR P10275 3/20 0.79
▸ NR3C2 P08235 2/20 0.79
▸ ESR1 P03372 1/20 0.79
▸ ESR2 Q92731 1/20 0.79

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
SCHEMBL7955302 0.91 PGR (1.00) PGRNR3C1ARNR3C2ESR1
SCHEMBL7954577 0.89 PGR (1.00) PGRNR3C1ARNR3C2ESR1
SCHEMBL12886097 0.87 PGR (1.00) PGRNR3C1ARNR3C2ESR1
SCHEMBL8863262 0.87 PGR (1.00) PGRNR3C1ARNR3C2ESR1
SCHEMBL5360125 0.86 PGR (0.76) PGRNR3C1ARNR3C2ESR1
SCHEMBL12899044 0.86 PGR (0.87) PGRNR3C1ARNR3C2ESR1
SCHEMBL4168024 0.83 NR3C1 (0.90) PGRNR3C1ARNR3C2ESR1
SCHEMBL7030695 0.83 PGR (0.75) PGRNR3C1ARNR3C2ESR1
SCHEMBL7092892 0.81 PGR (1.00) PGRNR3C1ARNR3C2ESR1
SCHEMBL5359646 0.79 PGR (0.73) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6268497-B1 CONVERTING LACTOL PRECURSOR TO ONE OF A SELECT NUMBER OF MIXED ACETAL DERIVATIVES, AND THEN TREATING ACETALS WITH A GRIGNARD REAGENT TO PROVIDE CHROMENOQUINOLINE COMPOUND LIGAND PHARMACEUTICALS INCORPORATED 2001-07-31 — — US disclosed
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