SCHEMBL7713753

SCHEMBL7713753

C=CC[C@H]1C[C@H]2[C@@H]3CC[C@H]4N(C)C(=O)CC[C@]4(C)[C@H]3CC[C@]2(C)[C@H]1NC1CC1

nearest known ligand 0.52

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SRD5A1 P18405 5/20 0.49
SRD5A2 P31213 1/20 0.49

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
SCHEMBL7713756 1.00 SRD5A1 (0.49) SRD5A1SRD5A2
SCHEMBL7621230 0.87 SRD5A1 (0.52) SRD5A1SRD5A2
SCHEMBL7621223 0.87 SRD5A1 (0.52) SRD5A1SRD5A2
SCHEMBL9067143 0.79 SRD5A1 (0.60) SRD5A1SRD5A2
SCHEMBL8925605 0.78 SRD5A2 (0.52) SRD5A1SRD5A2
SCHEMBL7609770 0.76 SRD5A1 (0.51) SRD5A1SRD5A2
SCHEMBL7609766 0.76 SRD5A1 (0.51) SRD5A1SRD5A2
SCHEMBL7615692 0.76 SRD5A1 (0.59) SRD5A1SRD5A2
SCHEMBL7615698 0.76 SRD5A1 (0.59) SRD5A1SRD5A2
SCHEMBL8926944 0.76 SRD5A1 (0.52) SRD5A1SRD5A2

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-6365597-B1 FOR THERAPY OF ANDROGEN AND ESTROGEN MEDIATED DISORDERS, INCLUDING BENIGN PROSTATIC HYPERPLASIA, ANDROGEN MEDIATED PROSTATE CANCER, ESTROGEN MEDIATED BREAST CANCER AND ACNE AVENTIS PHARMACEUTICALS INC. 2002-04-02 US disclosed