SCHEMBL14342102

SCHEMBL14342102

C[C@@H]1CC2=CC(=O)CC[C@@H]2C2C1C1CCC(=O)[C@@]1(C)C[C@H]2O

nearest known ligand 0.50

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
AR P10275 5/20 0.50
CYP19A1 P11511 12/20 0.49
SHBG P04278 2/20 0.44
PGR P06401 3/20 0.41
NR3C2 P08235 1/20 0.41

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
SCHEMBL4586771 1.00 AR (0.50) ARCYP19A1SHBGPGRNR3C2
SCHEMBL6376819 0.89 CYP19A1 (0.52) ARCYP19A1SHBGPGRNR3C2
SCHEMBL4588011 0.86 CYP19A1 (0.49) ARCYP19A1SHBGPGRNR3C2
SCHEMBL1897274 0.86 CYP19A1 (0.49) ARCYP19A1SHBGPGRNR3C2
SCHEMBL4588578 0.86 CYP19A1 (0.49) ARCYP19A1SHBGPGRNR3C2
SCHEMBL13804516 0.86 CYP19A1 (0.49) ARCYP19A1SHBGPGRNR3C2
SCHEMBL10947171 0.84 CYP19A1 (0.47) ARCYP19A1SHBGPGRNR3C2
SCHEMBL10943281 0.83 CYP19A1 (0.46) ARCYP19A1SHBGPGRNR3C2
SCHEMBL4587874 0.82 CYP19A1 (0.47) ARCYP19A1PGRNR3C2
SCHEMBL12902155 0.82 CYP19A1 (0.64) CYP19A1SHBGPGR

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
US-20070298456-A1 Microbiological process for the production of 7-substitued 11-hydroxy steroids, 7,17-substituted 11-halogen steroids, and uses thereof ZORN LUDWIG 2007-12-27 US disclosed
US-20070298456-A1 Microbiological process for the production of 7-substitued 11-hydroxy steroids, 7,17-substituted 11-halogen steroids, and uses thereof ZORN LUDWIG 2007-12-27 US disclosed
US-7262023-B2 Microbiological process for the production of 7-substituted 11-hydroxy steroids, 7,17-substituted 11-Halogen steroids and uses thereof BAYER SCHERING PHARMA AG (DE) 2007-08-28 US disclosed
US-7262023-B2 Microbiological process for the production of 7-substituted 11-hydroxy steroids, 7,17-substituted 11-Halogen steroids and uses thereof BAYER SCHERING PHARMA AG (DE) 2007-08-28 US disclosed