SCHEMBL14088484

SCHEMBL14088484

C=CC(=O)OCOc1ccc(-c2ccc(CCCCCC)cc2)cc1

nearest known ligand 0.65

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
THRB P10828 8/20 0.65
THRA P10827 6/20 0.52
MEN1 O00255 3/20 0.52
KMT2A Q03164 3/20 0.52
RARB P10826 7/20 0.50
ALDH1A1 P00352 2/20 0.50
RARA P10276 1/20 0.50
MAPT P10636 1/20 0.50
MTOR P42345 1/20 0.50
USP2 O75604 1/20 0.46
LMNA P02545 1/20 0.46
CYP3A4 P08684 1/20 0.46
MAPK1 P28482 1/20 0.46
CASP1 P29466 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
SLCO1B3 Q9NPD5 1/20 0.46
SLCO1B1 Q9Y6L6 1/20 0.46

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
SCHEMBL14010347 0.99 THRB (0.67) THRBTHRAMEN1KMT2ARARB
SCHEMBL14010397 0.95 THRB (0.60) THRBTHRAMEN1KMT2ARARB
SCHEMBL12154170 0.90 THRB (0.62) THRBTHRAMEN1KMT2ARARB
SCHEMBL14010389 0.90 THRB (0.64) THRBTHRAMEN1KMT2AALDH1A1
SCHEMBL12154162 0.88 RARB (0.58) THRBRARB
SCHEMBL16230828 0.88 RARB (0.58) THRBRARB
SCHEMBL14010388 0.87 RARB (0.56) THRBRARBCYP3A4
SCHEMBL14010395 0.87 TSHR (0.56) THRBRARBCYP3A4
SCHEMBL19930191 0.86 THRB (0.64) THRBTHRAMEN1KMT2AMAPT
SCHEMBL16425367 0.86 THRB (0.67) THRBTHRAMEN1KMT2AALDH1A1

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-7410677-B2 Organosilicon compound-containing polymerizable liquid-crystal composition CHISSO CORPORATION (JP) 2008-08-12 US disclosed