SCHEMBL8424832

SCHEMBL8424832

C=C1CCO[C@@]12CC[C@H]1[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3[C@@H](c3ccc(C(C)=O)cc3)C[C@@]12C

nearest known ligand 0.79

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PGR P06401 11/20 0.79
▸ NR3C1 P04150 10/20 0.53
▸ AR P10275 7/20 0.53
▸ CYP3A4 P08684 3/20 0.50
▸ LMNA P02545 2/20 0.42
▸ TSHR P16473 1/20 0.42
▸ CYP2C19 P33261 1/20 0.42
▸ HIF1A Q16665 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ ABCB11 O95342 1/20 0.42

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
SCHEMBL8427053 0.91 PGR (0.81) PGRNR3C1ARCYP3A4LMNA
SCHEMBL8427242 0.90 PGR (0.81) PGRNR3C1ARCYP3A4LMNA
SCHEMBL8423175 0.88 PGR (1.00) PGRNR3C1ARCYP3A4
SCHEMBL8427152 0.85 PGR (0.74) PGRNR3C1ARCYP3A4LMNA
SCHEMBL8427156 0.85 PGR (0.74) PGRNR3C1ARCYP3A4LMNA
SCHEMBL8423485 0.84 PGR (0.73) PGRNR3C1ARCYP3A4CYP2C19
SCHEMBL8424666 0.83 PGR (0.71) PGRNR3C1ARCYP3A4
SCHEMBL9019810 0.83 PGR (0.65) PGRNR3C1ARCYP3A4LMNA
SCHEMBL8768805 0.83 PGR (0.55) PGRNR3C1ARCYP3A4LMNA
SCHEMBL2122881 0.82 AR (0.59) PGRNR3C1ARCYP3A4LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0582338-B1 17-Spiromethylene steroids AKZO NOBEL NV (NL) 1999-10-20 — — EP disclosed
US-5854235-A 17-spiromethylene steroids AKZO NOBEL N.V. (NL) 1998-12-29 — — US disclosed
US-5712264-A 17-spiromethylene steroids AKZO NOBEL N.V. (NL) 1998-01-27 — — US disclosed
EP-0582338-A2 17-Spiromethylene steroids Akzo Nobel N.V. (NL) 1994-02-09 — — EP disclosed
Send feedback