SCHEMBL8539156

SCHEMBL8539156

CC(=O)Oc1c(C)c(C)c2c(c1C)CCC(C)(C(=O)N1CCC(C(O)(c3ccccc3)c3ccccc3)CC1)O2

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NPY2R P49146 6/20 0.43
TTPA P49638 2/20 0.43
ALOX5 P09917 1/20 0.43
ALDH1A1 P00352 1/20 0.42
PSEN1 P49768 3/20 0.39
RORC P51449 3/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
PDE4A P27815 1/20 0.39
PDE3A Q14432 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
SCHEMBL8541029 0.91 TTPA (0.42) NPY2RTTPAALOX5PSEN1MEN1
SCHEMBL8544247 0.83 TTPA (0.41) NPY2RTTPAALOX5PSEN1MEN1
SCHEMBL8542886 0.82 TTPA (0.46) TTPAALOX5ALDH1A1PSEN1MEN1
SCHEMBL8537141 0.79 TTPA (0.43) TTPAALOX5PSEN1MEN1KMT2A
SCHEMBL8538890 0.78 TTPA (0.51) TTPAALOX5PSEN1MEN1KMT2A
SCHEMBL8543139 0.76 TTPA (0.48) TTPAALOX5PSEN1MEN1KMT2A
SCHEMBL8543302 0.75 TTPA (0.45) TTPAALOX5PSEN1MEN1KMT2A
SCHEMBL9314929 0.75 TTPA (0.46) TTPAALOX5PSEN1MEN1KMT2A
SCHEMBL11705224 0.73 PTGS1 (0.66) TTPAALOX5PSEN1MEN1KMT2A
SCHEMBL11701874 0.73 PTGS1 (0.66) TTPAALOX5PSEN1MEN1KMT2A

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
EP-0587499-B1 Benzopyran compounds, process for their preparation and their use as cell protectors ADIR (FR) 1998-04-29 EP disclosed
US-5395834-A Antiarthritic agents or cardiovascular disorders ADIR ET COMPAGNIE (FR) 1995-03-07 US disclosed
US-5393775-A Administering a (2-chromanyl)alkylcarboxylic acid for disorders connected with peroxidation processes ADIR ET COMPAGNIE (FR) 1995-02-28 US disclosed