SCHEMBL8768158

SCHEMBL8768158

C=C(OCC)c1ccc([C@H]2C[C@@]3(C)[C@H](CC[C@]3(O)CCCOC3CCCCO3)[C@@H]3CC[C@@]4(O)CC5(CC[C@@H]4[C@H]32)OCCO5)cc1

nearest known ligand 0.30

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.30
▸ KMT2A Q03164 1/20 0.30

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
SCHEMBL8768790 0.90 MEN1 (0.35) MEN1KMT2A
SCHEMBL8768102 0.89 STS (0.33) MEN1KMT2A
SCHEMBL9176180 0.89 MEN1 (0.33) MEN1KMT2A
SCHEMBL8769017 0.89 MEN1 (0.33) MEN1KMT2A
SCHEMBL8768966 0.85 MEN1 (0.33) MEN1KMT2A
SCHEMBL13417509 0.77 PGR (0.35) —
SCHEMBL9171847 0.73 NR3C1 (0.39) —
SCHEMBL14666125 0.68 AR (0.35) MEN1KMT2A
SCHEMBL14656738 0.68 AR (0.35) MEN1KMT2A
SCHEMBL14666279 0.68 NR3C1 (0.36) —

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 disclosed
US-5426102-A Antigestagenic, antiandrogenic, antiglucocorticoid, antimineralcorticoid properties SCHERING AKTIENGESELLSCHAFT (DE) 1995-06-20 — — US disclosed
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