SCHEMBL14907438

SCHEMBL14907438

C=CC(=O)OCCCCCCOc1ccc(-c2ccc(C(=O)Oc3ccc(CCCCCCC)cc3F)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
THRB P10828 4/20 0.47
RARB P10826 4/20 0.45
FAAH O00519 3/20 0.43
SMN1; SMN2 Q16637 2/20 0.42
MAPT P10636 1/20 0.42
NPC1 O15118 2/20 0.42
LMNA P02545 2/20 0.42
NFKB1 P19838 1/20 0.42
NFKB2 Q00653 1/20 0.42
RELA Q04206 1/20 0.42
THRA P10827 3/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
PTPN11 Q06124 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 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
SCHEMBL14907436 1.00 THRB (0.47) THRBRARBFAAHSMN1; SMN2MAPT
SCHEMBL15582439 0.94 THRB (0.48) THRBRARBMAPTTHRAMEN1
SCHEMBL14907500 0.92 THRB (0.46) THRBFAAHSMN1; SMN2MAPTNPC1
SCHEMBL9475541 0.91 RARB (0.54) RARBFAAHSMN1; SMN2MAPTNPC1
SCHEMBL9405799 0.91 RARB (0.54) RARBFAAHSMN1; SMN2MAPTNPC1
SCHEMBL19757202 0.88 RARB (0.45) THRBRARBSMN1; SMN2MAPTNPC1
SCHEMBL10018716 0.88 THRB (0.60) THRBRARBSMN1; SMN2MAPTNPC1
SCHEMBL9996704 0.88 THRB (0.60) THRBRARBSMN1; SMN2MAPTNPC1
SCHEMBL13927210 0.88 THRB (0.60) THRBRARBSMN1; SMN2MAPTNPC1
SCHEMBL16425801 0.88 THRB (0.60) THRBRARBSMN1; SMN2MAPTNPC1

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
EP-2771735-B1 SWITCH ELEMENT COMPRISING A LIQUID CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2018-01-24 EP disclosed
US-9507185-B2 Switch element comprising a liquid crystalline medium MERCK PATENT GMBH (DE) 2016-11-29 US disclosed
US-9507185-B2 Switch element comprising a liquid crystalline medium MERCK PATENT GMBH (DE) 2016-11-29 US disclosed
US-20140293174-A1 SWITCH ELEMENT COMPRISING A LIQUID CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2014-10-02 US disclosed
US-20140293174-A1 SWITCH ELEMENT COMPRISING A LIQUID CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2014-10-02 US disclosed
WO-2013060406-A1 SWITCH ELEMENT COMPRISING A LIQUID CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2013-05-02 WO disclosed