SCHEMBL8630971

SCHEMBL8630971

CCCCOC(=O)OC1CCCCCC1

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 2/20 0.56
EPHX1 P07099 2/20 0.47
ALDH1A1 P00352 2/20 0.44
HTT P42858 2/20 0.42
ATM Q13315 1/20 0.41
EPHX2 P34913 1/20 0.40
HPGD P15428 1/20 0.39
TSHR P16473 1/20 0.39
CYP2C19 P33261 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
SCHEMBL451499 1.00 NAAA (0.56) NAAAEPHX1ALDH1A1HTTATM
SCHEMBL450933 0.98 NAAA (0.54) NAAAEPHX1ALDH1A1HTTATM
SCHEMBL11592192 0.95 NAAA (0.58) NAAAEPHX1ALDH1A1HTTEPHX2
SCHEMBL11590153 0.95 NAAA (0.58) NAAAEPHX1ALDH1A1HTTEPHX2
SCHEMBL11590755 0.95 NAAA (0.58) NAAAEPHX1ALDH1A1HTTEPHX2
SCHEMBL4350675 0.95 NAAA (0.58) NAAAEPHX1ALDH1A1HTTEPHX2
SCHEMBL8691011 0.95 NAAA (0.50) NAAAEPHX1ALDH1A1HTTATM
SCHEMBL4310566 0.93 NAAA (0.61) NAAAEPHX1ALDH1A1HTTEPHX2
SCHEMBL4343264 0.93 NAAA (0.57) NAAAEPHX1ALDH1A1HTTEPHX2
SCHEMBL8726389 0.92 NAAA (0.51) NAAAEPHX1ALDH1A1HTTATM

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
US-5827863-A Pyrazole derivatives as angiotensin II antagonists J. URIACH & CIA, S.A. (ES) 1998-10-27 US disclosed
US-5760025-A ADMINISTERING TESTOSTERONE 5A-REDUCTASE INHIBITORS SANKYO COMPANY, LIMITED (JP) 1998-06-02 US disclosed
US-5717088-A REACTING WITH A CYANOPHOSPHATE IN THE PRESENCE OF AN ALKALI METAL CYANIDE SANKYO COMPANY, LIMITED (JP) 1998-02-10 US disclosed
US-5698720-A INTERMEDIATES FOR TESTOSTERONE 5-ALPHA-REDUCTASE INHIBITORS SANKYO COMPANY, LIMITED (JP) 1997-12-16 US disclosed
EP-0567271-B1 Steroid derivatives for the treatment of prostatic hypertrophy, their preparation and uses SANKYO CO (JP) 1997-07-02 EP disclosed
EP-0725074-A2 Compounds suitable for use as intermediates in the preparation of Androst-3,5-dien-3-carboxy derivatives SANKYO COMPANY LIMITED (JP) 1996-08-07 EP disclosed
EP-0721454-A1 NEW PYRAZOLE DERIVATIVES AS ANGIOTENSIN II ANTAGONIST J. URIACH & CIA. S.A. (ES) 1996-07-17 EP disclosed
US-5536714-A Steroid derivatives for the treatment of prostatic hypertrophy their preparation and uses SANKYO COMPANY, LIMITED (JP) 1996-07-16 US disclosed
WO-1996004273-A1 NEW PYRAZOLE DERIVATIVES AS ANGIOTENSIN II ANTAGONIST J. URIACH & CIA, S.A. (ES) 1996-02-15 WO disclosed
EP-0567271-A2 Steroid derivatives for the treatment of prostatic hypertrophy, their preparation and uses SANKYO COMPANY LIMITED (JP) 1993-10-27 EP disclosed