SCHEMBL13797568

SCHEMBL13797568

C=CC1CC2=CC(=O)CCC2C2CCC(CC)(CCCCOC)C(C3CC3)[C@@H]12

nearest known ligand 0.48

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ AR P10275 18/20 0.48
▸ PGR P06401 16/20 0.48
▸ NR3C2 P08235 4/20 0.44
▸ LMNA P02545 1/20 0.33
▸ MAPT P10636 1/20 0.33

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
SCHEMBL13556639 0.82 AR (0.46) ARPGRNR3C2LMNAMAPT
SCHEMBL13770653 0.77 AR (0.48) ARPGRNR3C2LMNAMAPT
SCHEMBL13797499 0.76 AR (0.45) ARPGRNR3C2
SCHEMBL13473568 0.75 AR (0.49) ARPGRNR3C2LMNA
SCHEMBL13797345 0.72 PGR (0.48) ARPGRNR3C2LMNA
SCHEMBL13770481 0.71 AR (0.41) ARPGRNR3C2
SCHEMBL7700801 0.71 AR (0.58) ARPGRNR3C2LMNAMAPT
SCHEMBL6836545 0.71 AR (0.58) ARPGRNR3C2LMNAMAPT
SCHEMBL6836544 0.71 AR (0.58) ARPGRNR3C2LMNAMAPT
SCHEMBL7700797 0.71 AR (0.58) ARPGRNR3C2LMNAMAPT

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
WO-2009083271-A1 15,16-METHYLENE-17-(1'-PROPENYL)-17,3'-OXIDOESTRA-4-EN-3-ONE DERIVATIVE, USE THEREOF, AND MEDICAMENT CONTAINING SAID DERIVATIVE BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2009-07-09 — — WO disclosed
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