SCHEMBL9065994

SCHEMBL9065994

CCCCNC1CC[C@H]2[C@@H]3CCC4N(C)C(=O)CC[C@]4(C)[C@@H]3CC[C@]12C

nearest known ligand 0.66

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HSD17B7 P56937 2/20 0.63
SRD5A1 P18405 10/20 0.62
SRD5A2 P31213 2/20 0.60

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
SCHEMBL9065986 1.00 HSD17B7 (0.63) HSD17B7SRD5A1SRD5A2
SCHEMBL9067536 0.97 HSD17B7 (0.64) HSD17B7SRD5A1SRD5A2
SCHEMBL9067539 0.97 HSD17B7 (0.64) HSD17B7SRD5A1SRD5A2
SCHEMBL7615698 0.81 SRD5A1 (0.59) SRD5A1SRD5A2
SCHEMBL7615692 0.81 SRD5A1 (0.59) SRD5A1SRD5A2
SCHEMBL8904548 0.80 SRD5A1 (0.64) SRD5A1SRD5A2
SCHEMBL8904545 0.80 SRD5A1 (0.64) SRD5A1SRD5A2
SCHEMBL8996735 0.80 HSD17B7 (0.70) HSD17B7SRD5A1SRD5A2
SCHEMBL7711775 0.79 SRD5A1 (0.58) SRD5A1SRD5A2
SCHEMBL8724708 0.79 SRD5A1 (0.60) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5494914-A USEFUL FOR TREATMENT OF DISEASES WHOSE PROGRESS IS AIDED BY ACTIVATION OF ANDROGEN RECEPTORS ENDORECHERCHE (CA) 1996-02-27 US disclosed
EP-0641211-A1 INHIBITORS OF TESTOSTERONE 5$g(a)-REDUCTASE ACTIVITY ENDORECHERCHE INC. (CA) 1995-03-08 EP disclosed
WO-1993023053-A1 INHIBITORS OF TESTOSTERONE 5α-REDUCTASE ACTIVITY ENDORECHERCHE INC. (CA) 1993-11-25 WO disclosed