SCHEMBL7986932

SCHEMBL7986932

Cc1c(C)c2c(c(C)c1O)CCC(C)(COc1ccc(N)cc1)O2

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.61
MEN1 O00255 2/20 0.61
KMT2A Q03164 2/20 0.61
TDP1 Q9NUW8 1/20 0.61
PPARG P37231 1/20 0.53
LMNA P02545 2/20 0.47
USP2 O75604 2/20 0.47
CYP2C9 P11712 2/20 0.47
GSTP1 P09211 1/20 0.47
TTPA P49638 1/20 0.47
THRB P10828 1/20 0.47
CYP2C19 P33261 1/20 0.47
NR1I2 O75469 2/20 0.46
CYP3A4 P08684 2/20 0.44
TSHR P16473 2/20 0.44
PTGS1 P23219 1/20 0.44
PTGS2 P35354 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP4F2 P78329 1/20 0.44
ALOX5 P09917 4/20 0.43

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
SCHEMBL8003203 0.92 MAPT (0.64) MAPTMEN1KMT2ATDP1PPARG
SCHEMBL9530470 0.90 MAPT (0.50) MAPTMEN1KMT2ATDP1PPARG
SCHEMBL9075891 0.89 MAPT (0.50) MAPTMEN1KMT2ATDP1PPARG
SCHEMBL7492850 0.86 MAPT (0.59) MAPTMEN1KMT2ATDP1PPARG
SCHEMBL9630761 0.85 TDP1 (0.48) MAPTMEN1KMT2ATDP1PPARG
SCHEMBL9632107 0.84 MAPT (0.60) MAPTMEN1KMT2ATDP1PPARG
SCHEMBL8619704 0.84 MAPT (0.57) MAPTMEN1KMT2ATDP1PPARG
SCHEMBL7487350 0.84 MEN1 (0.52) MAPTMEN1KMT2ATDP1PPARG
SCHEMBL8172995 0.82 TDP1 (0.43) MAPTMEN1KMT2ATDP1PPARG
SCHEMBL7492546 0.80 MAPT (0.53) MAPTMEN1KMT2ATDP1PPARG

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2000010994-A1 PROCESS FOR THE PREPARATION OF 2-(ARYLOXYMETHYL)-2,5,7,8-TETRAMETHYLCHROMAN-6-OLS SANKYO COMPANY, LIMITED (JP) 2000-03-02 WO claimed
WO-2000010994-A1 PROCESS FOR THE PREPARATION OF 2-(ARYLOXYMETHYL)-2,5,7,8-TETRAMETHYLCHROMAN-6-OLS SANKYO COMPANY, LIMITED (JP) 2000-03-02 WO disclosed
WO-2000008009-A1 PROCESS FOR THE PREPARATION OF 2-(AMINOPHENOXYMETHYL) CHROMANS SANKYO COMPANY, LIMITED (JP) 2000-02-17 WO disclosed
EP-0556830-B1 Method for the preparation of 6-hydroxy-2,5,7,8-tetraalkyl-2-(4-aminophenoxymethyl)chromans LONZA AG (CH) 1996-04-24 EP disclosed
US-5310952-A Method for the preparation of 6-hydroxy-2,5,7,8-tetraalkyl-2-(4-aminophenoxymethyl) chromans LONZA LTD. (CH) 1994-05-10 US disclosed
EP-0556830-A1 Method for the preparation of 6-hydroxy-2,5,7,8-tetraalkyl-2-(4-aminophenoxymethyl)chromans LONZA AG (CH) 1993-08-25 EP disclosed