SCHEMBL8407329

SCHEMBL8407329

C[C@]12C[C@H](O)[C@H]3[C@@H](CC=C4CC5(CC[C@@H]43)OCCO5)[C@@H]1CCC21OCCO1

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ ESR1 P03372 2/20 0.31
▸ AR P10275 2/20 0.31
▸ ESR2 Q92731 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
SCHEMBL14535134 0.89 POLB (0.35) POLBMAPTESR1ARESR2
SCHEMBL7938353 0.87 POLB (0.34) POLBMAPT
SCHEMBL9273347 0.87 POLB (0.34) POLBMAPT
SCHEMBL7949847 0.85 POLB (0.34) POLBMAPTESR1ARESR2
SCHEMBL7944854 0.85 POLB (0.33) POLBMAPT
SCHEMBL8410110 0.85 PGR (0.36) POLBMAPTAR
SCHEMBL5891966 0.85 PGR (0.36) POLBMAPTAR
SCHEMBL7938354 0.85 POLB (0.36) POLBMAPT
SCHEMBL7947165 0.85 POLB (0.34) POLBMAPT
SCHEMBL7947160 0.84 POLB (0.32) POLBMAPT

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0643070-B1 Steroid intermediates and process for their preparation JENAPHARM GMBH (DE) 1999-07-21 — — EP disclosed
US-5831104-A Steroid intermediate products and method of their production JENAPHARM GMBH (DE) 1998-11-03 — — US disclosed
EP-0643070-A1 Steroid intermediates and process for their preparation JENAPHARM GmbH (DE) 1995-03-15 — — EP disclosed
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