SCHEMBL14010357

SCHEMBL14010357

C=CC(=O)OCOc1ccc(C(=O)Oc2ccc(CCCC)cc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 9/20 0.61
THRA P10827 5/20 0.51
MAPT P10636 4/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
KMT2A Q03164 3/20 0.46
MEN1 O00255 1/20 0.46
PRSS1 P07477 1/20 0.46
ACR P10323 1/20 0.46
LMNA P02545 3/20 0.45
NPC1 O15118 2/20 0.45
CYP1A2 P05177 2/20 0.45
CYP2C9 P11712 2/20 0.45
CYP2C19 P33261 2/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2D6 P10635 1/20 0.45
NFKB1 P19838 1/20 0.44
NFKB2 Q00653 1/20 0.44
RELA Q04206 1/20 0.44
TSHR P16473 2/20 0.41
HPGD P15428 1/20 0.41

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
SCHEMBL12404405 0.97 THRB (0.67) THRBTHRAMAPTSMN1; SMN2KMT2A
SCHEMBL19930191 0.94 THRB (0.64) THRBTHRAMAPTSMN1; SMN2KMT2A
SCHEMBL12154170 0.93 THRB (0.62) THRBTHRAMAPTSMN1; SMN2KMT2A
SCHEMBL16657529 0.93 THRB (0.64) THRBTHRAMAPTSMN1; SMN2KMT2A
SCHEMBL14010349 0.93 THRB (0.64) THRBTHRAMAPTSMN1; SMN2KMT2A
SCHEMBL19930193 0.91 THRB (0.56) THRBTHRAMAPTSMN1; SMN2KMT2A
SCHEMBL19930205 0.91 THRB (0.56) THRBTHRAMAPTSMN1; SMN2KMT2A
SCHEMBL19930189 0.90 THRB (0.51) THRBMAPTSMN1; SMN2KMT2APRSS1
SCHEMBL12733830 0.90 THRB (0.51) THRBMAPTSMN1; SMN2KMT2APRSS1
SCHEMBL16379487 0.90 THRB (0.60) THRBTHRAMAPTSMN1; SMN2KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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