SCHEMBL6941932

SCHEMBL6941932

CCCCCCOc1c(CBr)ccc2c(OCCCCCC)c(CBr)ccc12

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NR5A1 Q13285 1/20 0.41
THRA P10827 3/20 0.39
THRB P10828 3/20 0.39
SLC2A1 P11166 1/20 0.37
TLR4 O00206 2/20 0.37
TSHR P16473 2/20 0.37
TP53 P04637 1/20 0.37
FAAH O00519 1/20 0.36
MGLL Q99685 1/20 0.36
LTA4H P09960 3/20 0.36
PLA2G4B P0C869 1/20 0.36
HTR1B P28222 1/20 0.35
TLR8 Q9NR97 1/20 0.35

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
SCHEMBL2712841 0.84 TSHR (0.45) NR5A1THRATHRBTLR4TSHR
SCHEMBL668482 0.83 LTA4H (0.39) NR5A1THRATHRBSLC2A1TLR4
SCHEMBL6941633 0.82 NR5A1 (0.44) NR5A1THRATHRBSLC2A1TLR4
SCHEMBL2572575 0.79 THRA (0.49) NR5A1THRATHRBTLR4TSHR
SCHEMBL2957901 0.79 THRA (0.49) NR5A1THRATHRBTLR4TSHR
SCHEMBL31261699 0.77 KDM4E (0.43) NR5A1THRATHRBTSHRLTA4H
SCHEMBL13377572 0.76 NR5A1 (0.44) NR5A1THRATHRBTLR4TSHR
SCHEMBL862609 0.76 NR5A1 (0.44) NR5A1THRATHRBTLR4TSHR
SCHEMBL6941916 0.75 MAPT (0.42) NR5A1THRBLTA4H
SCHEMBL19583374 0.75 FAAH (0.53) NR5A1THRATHRBTSHRTP53

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
EP-1164178-B1 Electroluminescent devices having arylamine polymers EASTMAN KODAK CO (US) 2003-09-03 EP disclosed
EP-1164178-A1 Electroluminescent devices having arylamine polymers EASTMAN KODAK COMPANY (US) 2001-12-19 EP disclosed
US-6329086-B1 GOOD SOLUBILITY, EFFICIENCY AND STABILITY; EMITTING COLOR OF THE POLYMER CAN BE EASILY TUNED BY THE INCORPORATION OF DESIRED AROMATIC GROUP; POLYARYLENEVINYLENE EASTMAN KODAK COMPANY 2001-12-11 US disclosed