SCHEMBL8615056

SCHEMBL8615056

Cc1c(C)c2c(c(C)c1O)CCC(C)(COc1ccc(N(S)C(=O)Nc3ccc(C(C)C)cc3)cc1)O2

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.48
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
TDP1 Q9NUW8 1/20 0.48
PPARG P37231 1/20 0.48
ALOX5 P09917 5/20 0.39
NR1I2 O75469 2/20 0.39
LMNA P02545 2/20 0.38
GSTP1 P09211 1/20 0.38
TTPA P49638 1/20 0.38
USP2 O75604 1/20 0.38
THRB P10828 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
CYP4F2 P78329 1/20 0.37
PTGS1 P23219 1/20 0.36
PTGS2 P35354 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
TSHR P16473 1/20 0.36

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
SCHEMBL8619657 0.84 MEN1 (0.47) MAPTMEN1KMT2ATDP1PPARG
SCHEMBL8619593 0.83 PPARG (0.52) MAPTMEN1KMT2ATDP1PPARG
SCHEMBL8619704 0.80 MAPT (0.57) MAPTMEN1KMT2ATDP1PPARG
SCHEMBL8003203 0.76 MAPT (0.64) MAPTMEN1KMT2ATDP1PPARG
SCHEMBL7986932 0.75 MAPT (0.61) MAPTMEN1KMT2ATDP1PPARG
SCHEMBL8615053 0.74 PPARG (0.52) MAPTMEN1KMT2ATDP1PPARG
SCHEMBL8619591 0.74 PPARG (0.50) MAPTMEN1KMT2ATDP1PPARG
SCHEMBL8620604 0.73 KMT2A (0.50) MAPTMEN1KMT2ATDP1PPARG
SCHEMBL9632107 0.72 MAPT (0.60) MAPTMEN1KMT2ATDP1PPARG
SCHEMBL7492850 0.71 MAPT (0.59) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5747528-A Chroman derivatives as anti-oxidants WARNER-LAMBERT COMPANY (US) 1998-05-05 US claimed