SCHEMBL8425124

SCHEMBL8425124

C[C@H]1C[C@@]2(C)[C@@H](CC[C@]23OCCC3=O)[C@@H]2CCC3=CC(=O)CC[C@@H]3[C@H]21

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PGR P06401 9/20 0.62
▸ AR P10275 6/20 0.48
▸ NR3C2 P08235 3/20 0.48
▸ NR3C1 P04150 4/20 0.46
▸ LMNA P02545 2/20 0.46
▸ CYP3A4 P08684 2/20 0.46
▸ ABCB11 O95342 2/20 0.46
▸ CYP2C19 P33261 2/20 0.46
▸ TSHR P16473 1/20 0.46
▸ HIF1A Q16665 1/20 0.46
▸ ALDH1A1 P00352 1/20 0.46
▸ ESR1 P03372 1/20 0.46
▸ SHBG P04278 1/20 0.46
▸ ADRA2A P08913 1/20 0.46
▸ SLC6A4 P31645 1/20 0.46
▸ CYP19A1 P11511 2/20 0.45
▸ CHRM2 P08172 1/20 0.42
▸ ADORA3 P0DMS8 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ CHRM1 P11229 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
SCHEMBL8423621 0.87 PGR (0.63) PGRARNR3C2NR3C1LMNA
SCHEMBL8425076 0.84 PGR (0.64) PGRARNR3C2NR3C1LMNA
SCHEMBL8719020 0.82 PGR (0.59) PGRARNR3C2NR3C1LMNA
SCHEMBL8426836 0.80 PGR (0.52) PGRARNR3C2NR3C1LMNA
SCHEMBL782987 0.79 PGR (0.60) PGRARNR3C2NR3C1LMNA
SCHEMBL11424896 0.79 PGR (0.70) PGRARNR3C1LMNACYP3A4
SCHEMBL9614871 0.79 PGR (0.60) PGRARNR3C2NR3C1LMNA
SCHEMBL11793678 0.78 PGR (0.61) PGRARNR3C1LMNACYP3A4
SCHEMBL11794466 0.78 PGR (0.61) PGRARNR3C1LMNACYP3A4
Norgestomet SCHEMBL140382 0.77 PGR (1.00) PGRARNR3C2NR3C1LMNA

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-0582338-B1 17-Spiromethylene steroids AKZO NOBEL NV (NL) 1999-10-20 — — EP disclosed
EP-0582338-A2 17-Spiromethylene steroids Akzo Nobel N.V. (NL) 1994-02-09 — — EP disclosed
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