SCHEMBL11155804

SCHEMBL11155804

CO/C(=C1/CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)C3=CC[C@]12C)C(Cl)[S+]([O-])c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 18/20 0.55
NR3C1 P04150 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
SCHEMBL11155808 1.00 CYP19A1 (0.55) CYP19A1NR3C1
SCHEMBL11152804 0.91 CYP19A1 (0.56) CYP19A1NR3C1
SCHEMBL11152806 0.91 CYP19A1 (0.56) CYP19A1NR3C1
SCHEMBL11700924 0.85 CYP19A1 (0.56) CYP19A1NR3C1
SCHEMBL11700932 0.85 CYP19A1 (0.56) CYP19A1NR3C1
SCHEMBL11231087 0.77 CYP19A1 (0.56) CYP19A1NR3C1
SCHEMBL8999942 0.77 CYP19A1 (0.59) CYP19A1NR3C1
SCHEMBL11699719 0.75 CYP19A1 (0.51) CYP19A1NR3C1
SCHEMBL11699714 0.75 CYP19A1 (0.51) CYP19A1NR3C1
SCHEMBL11699726 0.75 CYP19A1 (0.51) CYP19A1NR3C1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4412955-A Preparation of corticoids from 17-keto steroids THE UPJOHN COMPANY (US) 1983-11-01 US claimed