SCHEMBL8767750

SCHEMBL8767750

C#C[C@]1(O)C=CC2C3CCC4=COCCC4C3[C@@H](c3ccc(-c4ccc(C#N)cc4)cc3)C[C@@]21C

nearest known ligand 0.31

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PGR P06401 3/20 0.31
▸ AR P10275 2/20 0.31
▸ LMNA P02545 1/20 0.31
▸ ESR1 P03372 1/20 0.31
▸ SLC6A4 P31645 1/20 0.31
▸ OPRM1 P35372 1/20 0.31
▸ NR3C1 P04150 2/20 0.31

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
SCHEMBL8768210 0.91 NR3C1 (0.32) PGRARNR3C1
SCHEMBL8767962 0.90 PGR (0.32) PGRARNR3C1
SCHEMBL8768225 0.85 PGR (0.47) PGRARLMNAESR1SLC6A4
SCHEMBL8768220 0.85 PGR (0.47) PGRARLMNAESR1SLC6A4
SCHEMBL8768235 0.85 PGR (0.33) PGRARNR3C1
SCHEMBL8767741 0.84 NR3C1 (0.30) PGRARNR3C1
SCHEMBL8767904 0.79 — —
SCHEMBL8768965 0.76 NR3C1 (0.45) PGRARLMNAESR1SLC6A4
SCHEMBL8768205 0.76 NR3C1 (0.45) PGRARLMNAESR1SLC6A4
SCHEMBL7200584 0.75 PGR (0.37) PGRARESR1NR3C1

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-0567469-B1 14beta-H-, 14- AND 15-EN-11beta-ARYL-4-ESTRENES SCHERING AG (DE) 1997-08-27 — — EP claimed
EP-0567469-B1 14beta-H-, 14- AND 15-EN-11beta-ARYL-4-ESTRENES SCHERING AG (DE) 1997-08-27 — — EP disclosed
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