SCHEMBL4199850

SCHEMBL4199850

CC[C@@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@H]3CC[C@]12C

nearest known ligand 0.71

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 15/20 0.71
CYP3A4 P08684 1/20 0.61
LMNA P02545 2/20 0.59
MAPT P10636 2/20 0.59

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
SCHEMBL4199851 1.00 CYP19A1 (0.71) CYP19A1CYP3A4LMNAMAPT
SCHEMBL14027916 1.00 CYP19A1 (0.71) CYP19A1CYP3A4LMNAMAPT
Acetone SCHEMBL9504391 0.96 CYP19A1 (0.69) CYP19A1CYP3A4LMNAMAPT
SCHEMBL10882654 0.87 CYP19A1 (0.70) CYP19A1CYP3A4LMNAMAPT
SCHEMBL11365883 0.87 CYP19A1 (0.54) CYP19A1CYP3A4LMNAMAPT
SCHEMBL10895875 0.86 CYP19A1 (0.69) CYP19A1CYP3A4LMNAMAPT
SCHEMBL9015138 0.86 CYP19A1 (0.69) CYP19A1CYP3A4LMNAMAPT
SCHEMBL29904015 0.85 CYP19A1 (0.71) CYP19A1CYP3A4LMNAMAPT
SCHEMBL24101855 0.85 CYP19A1 (0.69) CYP19A1CYP3A4LMNAMAPT
SCHEMBL14046282 0.84 CYP19A1 (0.76) CYP19A1CYP3A4LMNAMAPT

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-2024383-A2 CRYSTALLINE FORMS OF 11 BETA-(4-ACETYLPHENYL)-20,20,21,21,21-PENTAFLUOR-17ALPHA- HYDROXY-19-NOR-17 -PREGNA-4,9-DIEN-3-ONE Bayer Schering Pharma Aktiengesellschaft (DE) 2009-02-18 EP claimed
WO-2007140917-A2 CRYSTALLINE FORMS OF 11 ß-(4-ACETYLPHENYL)-20,20,21,21,21-PENTAFLUOR-17- HYDROXY-19-NOR-17α-PREGNA-4,9-DIEN-3-ONE BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2007-12-13 WO claimed
EP-2024383-A2 CRYSTALLINE FORMS OF 11 BETA-(4-ACETYLPHENYL)-20,20,21,21,21-PENTAFLUOR-17ALPHA- HYDROXY-19-NOR-17 -PREGNA-4,9-DIEN-3-ONE Bayer Schering Pharma Aktiengesellschaft (DE) 2009-02-18 EP disclosed
WO-2007140917-A2 CRYSTALLINE FORMS OF 11 ß-(4-ACETYLPHENYL)-20,20,21,21,21-PENTAFLUOR-17- HYDROXY-19-NOR-17α-PREGNA-4,9-DIEN-3-ONE BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2007-12-13 WO disclosed