SCHEMBL7799982

SCHEMBL7799982

CC1CC2c3ccccc3CCC2N(C)C1=O

nearest known ligand 0.65

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SRD5A1 P18405 13/20 0.65
HTR1A P08908 2/20 0.51
SIGMAR1 Q99720 3/20 0.44
SRD5A2 P31213 2/20 0.43

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
SCHEMBL7799873 0.82 SRD5A1 (0.67) SRD5A1SRD5A2
SCHEMBL7799921 0.79 SRD5A1 (1.00) SRD5A1HTR1ASIGMAR1SRD5A2
SCHEMBL7789453 0.79 SRD5A1 (1.00) SRD5A1HTR1ASIGMAR1SRD5A2
SCHEMBL7789452 0.79 SRD5A1 (1.00) SRD5A1HTR1ASIGMAR1SRD5A2
SCHEMBL6249826 0.72 SRD5A1 (0.44) SRD5A1HTR1ASIGMAR1
SCHEMBL18779970 0.71 SRD5A1 (0.57) SRD5A1HTR1ASIGMAR1
SCHEMBL18779969 0.71 SRD5A1 (0.57) SRD5A1HTR1ASIGMAR1
SCHEMBL15887271 0.70 HTR1A (0.66) SRD5A1HTR1ASIGMAR1
SCHEMBL8900313 0.70 HTR1A (0.67) SRD5A1HTR1ASIGMAR1
SCHEMBL5603849 0.70 AKR1C3 (0.45) SRD5A1HTR1ASIGMAR1

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-2968219-A1 NOVEL THERAPY FOR PROSTATE CARCINOMA Pellficure Pharmaceuticals, Inc. (US) 2016-01-20 EP disclosed
WO-2014158875-A1 NOVEL THERAPY FOR PROSTATE CARCINOMA PELLFICURE PHARMACEUTICALS INC. (US) 2014-10-02 WO disclosed
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-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