SCHEMBL8959763

SCHEMBL8959763

CCCC(CCCCCCC(=O)O)c1ccccc1-c1ccc(CC(C)C)cc1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYSLTR2 Q9NS75 1/20 0.47
CYSLTR1 Q9Y271 1/20 0.47
MME P08473 5/20 0.42
ACE P12821 2/20 0.42
BRS3 P32247 3/20 0.41
PPARA Q07869 2/20 0.40
PPARG P37231 1/20 0.40
FFAR1 O14842 2/20 0.39
FFAR4 Q5NUL3 1/20 0.39
LTB4R2 Q9NPC1 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
SCHEMBL8959766 0.82 PTGS1 (0.44) MMEACE
SCHEMBL11692783 0.81 CYSLTR2 (0.59) CYSLTR2CYSLTR1FFAR1FFAR4
SCHEMBL8959593 0.81 PTGS1 (0.48) FFAR1FFAR4
SCHEMBL8959585 0.81 PTGS1 (0.48) FFAR1FFAR4
SCHEMBL8959758 0.80 CYSLTR2 (0.45) CYSLTR2CYSLTR1MMEACEPPARA
SCHEMBL8959834 0.76 PTGS1 (0.48) CYSLTR2CYSLTR1FFAR1FFAR4
SCHEMBL8959881 0.74 PTGS1 (0.49) CYSLTR2CYSLTR1FFAR1FFAR4
SCHEMBL9152883 0.73 RARB (0.46) CYSLTR2CYSLTR1BRS3LTB4R2
SCHEMBL10385075 0.73 PTGS2 (0.57) MMEACEPPARAPPARG
SCHEMBL29074125 0.72 CYSLTR2 (0.52) CYSLTR2CYSLTR1PPARAPPARGFFAR1

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-5530019-A FOR TREATMENT OF PROSTATE GLAND DISORDERS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-06-25 US disclosed
EP-0648208-A1 INDOLE DERIVATIVES AS TESTOSTERONE 5 ALPHA-REDUCTASE INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1995-04-19 EP disclosed
WO-1994022821-A1 INDOLE DERIVATIVES AS TESTOSTERONE 5 ALPHA-REDUCTASE INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1994-10-13 WO disclosed