SCHEMBL7797739

SCHEMBL7797739

O=C1CC[C@H]2c3ccccc3CC[C@H]2N1

nearest known ligand 0.64

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SRD5A1 P18405 4/20 0.64
PARP1 P09874 1/20 0.44
SIGMAR1 Q99720 3/20 0.39
IDO1 P14902 2/20 0.39
PDPK1 O15530 1/20 0.39
NPY5R Q15761 1/20 0.38
RAB9A P51151 1/20 0.38

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
SCHEMBL7789498 1.00 SRD5A1 (0.64) SRD5A1PARP1SIGMAR1IDO1PDPK1
SCHEMBL698224 1.00 SRD5A1 (0.64) SRD5A1PARP1SIGMAR1IDO1PDPK1
SCHEMBL698225 1.00 SRD5A1 (0.64) SRD5A1PARP1SIGMAR1IDO1PDPK1
SCHEMBL9964019 0.88 SRD5A1 (0.54) SRD5A1PARP1RAB9A
SCHEMBL1952744 0.88 SRD5A1 (0.54) SRD5A1PARP1RAB9A
SCHEMBL1952747 0.88 SRD5A1 (0.54) SRD5A1PARP1RAB9A
SCHEMBL1207971 0.88 SRD5A1 (0.54) SRD5A1PARP1RAB9A
SCHEMBL21357347 0.87 SRD5A1 (0.49) SRD5A1PARP1SIGMAR1IDO1PDPK1
SCHEMBL7797837 0.78 SRD5A1 (1.00) SRD5A1NPY5R
SCHEMBL7796251 0.78 SRD5A1 (0.70) SRD5A1

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