SCHEMBL9482185

SCHEMBL9482185

CN1C(=O)C=C[C@@]2(C)C1CC[C@@H]1[C@H]2CC[C@]2(C)C(=O)CC[C@@H]12

nearest known ligand 0.64

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AR P10275 9/20 0.64
KCNH2 Q12809 8/20 0.63

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
SCHEMBL13656762 1.00 AR (0.64) ARKCNH2
SCHEMBL5420574 0.85 AR (0.58) ARKCNH2
SCHEMBL9113552 0.80 AR (0.64) ARKCNH2
SCHEMBL14300609 0.80 AR (0.64) ARKCNH2
SCHEMBL9221841 0.80 AR (0.64) ARKCNH2
SCHEMBL4268107 0.80 AR (0.62) ARKCNH2
SCHEMBL13656783 0.80 AR (0.62) ARKCNH2
SCHEMBL13656800 0.80 AR (0.64) ARKCNH2
SCHEMBL13656798 0.80 AR (0.69) ARKCNH2
SCHEMBL4268103 0.80 AR (0.62) ARKCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5237065-A Steroid 5-alpha-reductase inhibitors SMITHKLINE BEECHAM CORPORATION (US) 1993-08-17 US disclosed
EP-0277002-B1 STEROID-5-ALPHA-REDUCTASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 1992-06-17 EP disclosed
US-5110939-A Antiandrogens SMITHKLINE BEECHAM CORPORATION (US) 1992-05-05 US disclosed
US-4888336-A DECREASE DIHYDROTESTOSTERONE ACTIVITY SMITHKLINE BECKMAN CORPORATION (US) 1989-12-19 US disclosed
EP-0277002-A2 Steroid-5-alpha-reductase inhibitors SMITHKLINE BEECHAM CORPORATION (US) 1988-08-03 EP disclosed