SCHEMBL10346387

SCHEMBL10346387

COc1c(C)c(C)c2c(c1C)CCC(C)(CCOS(=O)(=O)c1ccc(C)cc1)O2

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
PDE4A P27815 1/20 0.40
PDE3A Q14432 1/20 0.40
GSTO1 P78417 2/20 0.39
PSEN1 P49768 5/20 0.39
PTPN1 P18031 1/20 0.37
AKT1 P31749 1/20 0.37
TTPA P49638 2/20 0.35
ALOX5 P09917 1/20 0.35
MAPT P10636 2/20 0.35
LMNA P02545 1/20 0.35
GSTP1 P09211 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
SCHEMBL10346651 0.94 MEN1 (0.43) MEN1KMT2APDE4APDE3AGSTO1
SCHEMBL4864444 0.90 PSEN1 (0.40) MEN1KMT2APDE4APDE3AGSTO1
SCHEMBL11445274 0.85 PSEN1 (0.41) MEN1KMT2APDE4APDE3AGSTO1
SCHEMBL11445076 0.85 PSEN1 (0.41) MEN1KMT2APDE4APDE3AGSTO1
SCHEMBL9096806 0.83 MEN1 (0.39) MEN1KMT2APDE4APDE3AGSTO1
SCHEMBL8950693 0.81 MEN1 (0.39) MEN1KMT2APDE4APDE3AGSTO1
SCHEMBL8950708 0.80 MEN1 (0.41) MEN1KMT2APDE4APDE3AGSTO1
SCHEMBL29180347 0.77 MEN1 (0.45) MEN1KMT2APDE4APDE3AGSTO1
SCHEMBL10346383 0.74 MEN1 (0.46) MEN1KMT2APDE4APDE3AGSTO1
SCHEMBL10346932 0.74 MEN1 (0.48) MEN1KMT2APDE4APDE3AGSTO1

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-0202580-B1 3,4-DIHYDROBENZOPYRAN DERIVATIVES KURARAY CO., LTD. (JP) 1990-03-28 EP disclosed
US-4728650-A ANTIULCER, ANTITUSSIVE, EXPECTORANTS KURARAY CO., LTD. (JP) 1988-03-01 US disclosed
EP-0202580-A2 3,4-Dihydrobenzopyran derivatives KURARAY CO., LTD. (JP) 1986-11-26 EP disclosed