SCHEMBL9314929

SCHEMBL9314929

CC(=O)Oc1c(C)c(C)c2c(c1C)CCC(C)(C(=O)N(c1ccccc1)C1CC1)O2

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TTPA P49638 2/20 0.46
ALOX5 P09917 2/20 0.46
PSEN1 P49768 9/20 0.42
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
PDE4A P27815 1/20 0.41
PDE3A Q14432 1/20 0.41
PTGS1 P23219 1/20 0.41
PTGS2 P35354 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
TSHR P16473 1/20 0.41
BCHE P06276 1/20 0.37
ACHE P22303 1/20 0.35
MAOB P27338 1/20 0.35

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
SCHEMBL9312702 0.86 PTGS1 (0.58) TTPAALOX5PSEN1PTGS1PTGS2
SCHEMBL9314035 0.80 TTPA (0.47) TTPAALOX5PSEN1MEN1KMT2A
SCHEMBL9314914 0.80 PSEN1 (0.52) TTPAALOX5PSEN1MEN1KMT2A
SCHEMBL9314867 0.80 TTPA (0.44) TTPAALOX5PSEN1MEN1KMT2A
SCHEMBL9314093 0.79 TTPA (0.47) TTPAALOX5PSEN1MEN1KMT2A
SCHEMBL9314872 0.79 TTPA (0.43) TTPAALOX5PSEN1MEN1KMT2A
SCHEMBL7836285 0.78 TTPA (0.46) TTPAALOX5PSEN1MEN1KMT2A
SCHEMBL9312843 0.77 TTPA (0.42) TTPAALOX5PSEN1MEN1KMT2A
SCHEMBL11705224 0.77 PTGS1 (0.66) TTPAALOX5PSEN1MEN1KMT2A
SCHEMBL11701874 0.77 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5315017-A Peroxidation and eicosanoid biosynthesis inhibition ADIR ET COMPAGNIE (FR) 1994-05-24 US disclosed
EP-0512899-A1 Benzopyran compounds, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1992-11-11 EP disclosed