SCHEMBL4555922

SCHEMBL4555922

[CH]=Cc1cc(OCCCCCCC)[c]cc1OCCCCCCC

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 2/20 0.34
THRA P10827 1/20 0.34
ESR1 P03372 2/20 0.34
TLR8 Q9NR97 1/20 0.33
TLR4 O00206 2/20 0.33
MAPT P10636 2/20 0.33
CHUK O15111 1/20 0.33
DAPK3 O43293 1/20 0.33
JAK2 O60674 1/20 0.33
ROCK2 O75116 1/20 0.33
PRKCG P05129 1/20 0.33
CDK1 P06493 1/20 0.33
PIM1 P11309 1/20 0.33
RPS6KB1 P23443 1/20 0.33
CDK2 P24941 1/20 0.33
AKT1 P31749 1/20 0.33
AKT2 P31751 1/20 0.33
MAPKAPK2 P49137 1/20 0.33
BLK P51451 1/20 0.33
RPS6KA3 P51812 1/20 0.33

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
SCHEMBL2198964 1.00 THRB (0.34) THRBTHRAESR1TLR8TLR4
SCHEMBL7043526 1.00 THRB (0.34) THRBTHRAESR1TLR8TLR4
SCHEMBL3278113 1.00 THRB (0.34) THRBTHRAESR1TLR8TLR4
SCHEMBL7150408 0.92 SMPD1 (0.35) S1PR2S1PR1S1PR3LPAR2SMPD1
SCHEMBL8508182 0.92 SMPD1 (0.35) S1PR2S1PR1S1PR3LPAR2SMPD1
SCHEMBL6935822 0.85 AHR (0.36) THRBTHRAESR1SMPD1
SCHEMBL4323385 0.75 MEN1 (0.36) THRBTHRAESR1TLR8TLR4
SCHEMBL28103477 0.74 CYP1A2 (0.39) THRBTHRAESR1TLR8MAPT
SCHEMBL4622609 0.73 NR5A1 (0.44) THRBTHRAMEN1LMNAKMT2A
SCHEMBL4623426 0.73 NR5A1 (0.44) THRBTHRAMEN1LMNAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7511422-B2 Organic electroluminescent element with specific structure connecting luminescent regions and organic electroluminescent device including the same KABUSHIKI KAISHA TOYOTA JIDOSHOKKI (JP) 2009-03-31 US disclosed
US-20050073251-A1 Organic electroluminescent element and organic electroluminescent device including the same KABUSHIKI KAISHA TOYOTA JIDOSHOKKI (JP) 2005-04-07 US disclosed
EP-1521305-A2 Organic electroluminescent element and organic electroluminescent device including the same Kabushiki Kaisha Toyota Jidoshokki (JP) 2005-04-06 EP disclosed