SCHEMBL1422445

SCHEMBL1422445

C[C@]12CCC(=O)C=C1C(CO)C[C@@H]1[C@@H]2CC[C@]2(C)C(=O)CC[C@@H]12

nearest known ligand 0.80

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 20/20 0.80

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
SCHEMBL3953307 1.00 CYP19A1 (0.80) CYP19A1
SCHEMBL8491448 0.85 CYP19A1 (1.00) CYP19A1
SCHEMBL8491442 0.85 CYP19A1 (1.00) CYP19A1
SCHEMBL8492264 0.85 CYP19A1 (1.00) CYP19A1
SCHEMBL8494957 0.84 CYP19A1 (0.78) CYP19A1
SCHEMBL8494949 0.84 CYP19A1 (0.78) CYP19A1
SCHEMBL10630637 0.84 CYP19A1 (1.00) CYP19A1
SCHEMBL13752911 0.84 CYP19A1 (1.00) CYP19A1
SCHEMBL21265253 0.84 CYP19A1 (1.00) CYP19A1
SCHEMBL22863633 0.84 CYP19A1 (1.00) CYP19A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009034398-A1 PROCESS FOR THE SYNTHESIS OF 6-HYDROXYMETHYL-L,4- ANDROSTADIEN-3.17-DIONE RICHTER GEDEON NYRT. (HU) 2009-03-19 WO claimed
EP-2069382-B1 PROCESS FOR THE SELECTIVE ISOLATION, PURIFICATION AND SEPARATION OF MONOHYDROXYLATED 3,17-DIKETO-STEROID COMPOUNDS RICHTER GEDEON NYRT (HU) 2011-03-23 EP disclosed
EP-2069382-A1 PROCESS FOR THE SELECTIVE ISOLATION, PURIFICATION AND SEPARATION OF MONOHYDROXYLATED 3,17-DIKETO-STEROID COMPOUNDS Richter Gedeon NYRT (HU) 2009-06-17 EP disclosed
WO-2009034398-A1 PROCESS FOR THE SYNTHESIS OF 6-HYDROXYMETHYL-L,4- ANDROSTADIEN-3.17-DIONE RICHTER GEDEON NYRT. (HU) 2009-03-19 WO disclosed
WO-2009034398-A1 PROCESS FOR THE SYNTHESIS OF 6-HYDROXYMETHYL-L,4- ANDROSTADIEN-3.17-DIONE RICHTER GEDEON NYRT. (HU) 2009-03-19 WO disclosed
WO-2008032131-A1 PROCESS FOR THE SELECTIVE ISOLATION, PURIFICATION AND SEPARATION OF MONOHYDROXYLATED 3,17-DIKETO-STEROID COMPOUNDS RICHTER GEDEON NYRT. (HU) 2008-03-20 WO disclosed