SCHEMBL8978639

SCHEMBL8978639

CC(C)N(C(=O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4N(C)C(=O)CC[C@]4(C)[C@H]3CC[C@]12C)C(=O)N(C(C)C)C(C)C

nearest known ligand 0.83

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SRD5A2 P31213 3/20 0.78
SRD5A1 P18405 1/20 0.69

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
SCHEMBL8978642 1.00 SRD5A2 (0.78) SRD5A2SRD5A1
SCHEMBL9210140 0.92 SRD5A2 (0.75) SRD5A2SRD5A1
SCHEMBL9213225 0.92 SRD5A2 (0.75) SRD5A2SRD5A1
Turosteride SCHEMBL62002 0.88 SRD5A2 (1.00) SRD5A2SRD5A1
Turosteride SCHEMBL9402862 0.88 SRD5A2 (1.00) SRD5A2SRD5A1
Turosteride SCHEMBL22032591 0.88 SRD5A2 (1.00) SRD5A2SRD5A1
Turosteride SCHEMBL16412164 0.88 SRD5A2 (1.00) SRD5A2SRD5A1
Turosteride SCHEMBL9211714 0.88 SRD5A2 (1.00) SRD5A2SRD5A1
SCHEMBL9208029 0.87 SRD5A2 (0.73) SRD5A2SRD5A1
SCHEMBL9208022 0.87 SRD5A2 (0.73) SRD5A2SRD5A1

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-5583138-A REDUCTASE INHIBITOR; SKIN DISORDERS RICHTER GEDEON VEGYESZETI GYAR RT. (HU) 1996-12-10 US disclosed
EP-0662977-A1 NOVEL 17$g(b)-SUBSTITUTED 4-AZAANDROSTANE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND PROCESS FOR PREPARING SAME RICHTER GEDEON VEGYESZETI GYAR R.T. (HU) 1995-07-19 EP disclosed
WO-1994007909-A1 NOVEL 17β-SUBSTITUTED 4-AZAANDROSTANE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND PROCESS FOR PREPARING SAME Richter Gedeon Vegyészeti Gyár Rt. (HU) 1994-04-14 WO disclosed