SCHEMBL14010347

SCHEMBL14010347

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

nearest known ligand 0.67

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
THRB P10828 9/20 0.67
THRA P10827 7/20 0.51
MEN1 O00255 3/20 0.50
KMT2A Q03164 3/20 0.50
RARB P10826 5/20 0.49
ALDH1A1 P00352 2/20 0.48
RARA P10276 1/20 0.48
MAPT P10636 1/20 0.48
MTOR P42345 1/20 0.48
HPGD P15428 1/20 0.45
TSHR P16473 1/20 0.45
USP2 O75604 1/20 0.44
LMNA P02545 1/20 0.44
CYP3A4 P08684 1/20 0.44
MAPK1 P28482 1/20 0.44
CASP1 P29466 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
SLCO1B3 Q9NPD5 1/20 0.44
SLCO1B1 Q9Y6L6 1/20 0.44

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
SCHEMBL14088484 0.99 THRB (0.65) THRBTHRAMEN1KMT2ARARB
SCHEMBL14010397 0.96 THRB (0.60) THRBTHRAMEN1KMT2ARARB
SCHEMBL12154170 0.91 THRB (0.62) THRBTHRAMEN1KMT2ARARB
SCHEMBL14010389 0.91 THRB (0.64) THRBTHRAMEN1KMT2AALDH1A1
SCHEMBL14010388 0.88 RARB (0.56) THRBRARBHPGDTSHRCYP3A4
SCHEMBL14010395 0.88 TSHR (0.56) THRBRARBHPGDTSHRCYP3A4
SCHEMBL16425367 0.87 THRB (0.67) THRBTHRAMEN1KMT2AALDH1A1
SCHEMBL12404405 0.87 THRB (0.67) THRBTHRAMEN1KMT2AMAPT
SCHEMBL12154162 0.87 RARB (0.58) THRBRARBHPGDTSHR
SCHEMBL16230828 0.87 RARB (0.58) THRBRARBHPGDTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9505980-B2 Polymerizable liquid crystal composition and optically anisotropic substance having twist alignment JNC CORPORATION (JP) 2016-11-29 US disclosed
US-9399736-B2 Optically anisotropic substance and liquid crystal display JNC CORPORATION (JP) 2016-07-26 US disclosed
US-20160011349-A1 INFRARED REFLECTING FILM AND LAMINATED FILM JNC PETROCHEMICAL CORPORATION (JP) 2016-01-14 US disclosed
US-20150146156-A1 OPTICALLY ANISOTROPIC SUBSTANCE AND LIQUID CRYSTAL DISPLAY JNC CORPORATION (JP) 2015-05-28 US disclosed
US-20150108401-A1 POLYMERIZABLE LIQUID CRYSTAL COMPOSITION AND OPTICALLY ANISOTROPIC SUBSTANCE HAVING TWIST ALIGNMENT JNC CORPORATION (JP) 2015-04-23 US disclosed
US-7449223-B2 containing an additive that improves the level of defects in the vicinity of the air interface for an optically anisotropic medium that exhibits either tilted alignment or horizontal alignment DAINIPPON INK AND CHEMICALS, INC. (JP) 2008-11-11 US disclosed
US-20070170394-A1 Polymerizable liquid crystal composition and optically anisotropic medium DAINIPPON INK AND CHEMICALS, INC. (JP) 2007-07-26 US disclosed