SCHEMBL7796412

SCHEMBL7796412

CN1C(=O)CC[C@H]2c3cc(N)ccc3CC[C@@H]21

nearest known ligand 0.66

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SRD5A1 P18405 16/20 0.66
SRD5A2 P31213 2/20 0.60
CYP2D6 P10635 1/20 0.40
TSHR P16473 1/20 0.40
SLC6A2 P23975 1/20 0.40
SLC6A4 P31645 1/20 0.40
SLC6A3 Q01959 1/20 0.40
LMNA P02545 1/20 0.39

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
SCHEMBL7796407 1.00 SRD5A1 (0.66) SRD5A1SRD5A2CYP2D6TSHRSLC6A2
SCHEMBL7798978 0.83 SRD5A1 (0.80) SRD5A1SRD5A2
SCHEMBL7798977 0.83 SRD5A1 (0.80) SRD5A1SRD5A2
SCHEMBL7789452 0.80 SRD5A1 (1.00) SRD5A1SRD5A2
SCHEMBL7799921 0.80 SRD5A1 (1.00) SRD5A1SRD5A2
SCHEMBL7789453 0.80 SRD5A1 (1.00) SRD5A1SRD5A2
SCHEMBL7799877 0.79 SRD5A1 (0.60) SRD5A1SRD5A2
SCHEMBL7799881 0.79 SRD5A1 (0.60) SRD5A1SRD5A2
SCHEMBL7796278 0.77 SRD5A1 (0.71) SRD5A1SRD5A2
SCHEMBL7796276 0.77 SRD5A1 (0.71) 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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0591583-B1 Benzo (f) quinolinones as 5-alpha-reductase inhibitors LILLY CO ELI (US) 2001-12-19 EP disclosed
EP-0532190-B1 Benzo(f)quinolinones as 5-alpha-reductase inhibitors LILLY CO ELI (US) 2000-12-27 EP disclosed
US-5710163-A STEROID 5A-REDUCTASE INHIBITORS ELI LILLY AND COMPANY (US) 1998-01-20 US disclosed
US-5670512-A SKIN DISORDERS; REDUCTASE INHIBITORS ELI LILLY AND COMPANY (US) 1997-09-23 US disclosed
US-5541190-A TREATING BENIGN PROSTATIC HYPERPLASIA, MALE PATTERN BALDNESS, PROSTATIC CANCER, ANDROGENIC ALOPECIA ELI LILLY AND COMPANY (US) 1996-07-30 US disclosed
US-5495021-A STEROID 5 ALPHA-REDUCTASE INHIBITORS ELI LILLY AND COMPANY (US) 1996-02-27 US disclosed
US-5334767-A Steroid 5a-reductase inhibitor ELI LILLY AND COMPANY (US) 1994-08-02 US disclosed
EP-0591583-A1 Benzo (f) quinolinones as 5-alpha-reductase inhibitors ELI LILLY AND COMPANY (US) 1994-04-13 EP disclosed
US-5239075-A PROCESS FOR THE PREPARATION OF BENZO (F) QUINOLINONES ELI LILLY AND COMPANY (US) 1993-08-24 US disclosed
EP-0532190-A2 Benzo f quinolinones as 5-alpha-reductase inhibitors ELI LILLY AND COMPANY (US) 1993-03-17 EP disclosed