SCHEMBL17264205

SCHEMBL17264205

CCCCCCCCCCCCC(=O)CCCSc1ccc(OC)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.53
LMNA P02545 1/20 0.53
MTNR1A P48039 1/20 0.50
MTNR1B P49286 1/20 0.50
CNR1 P21554 3/20 0.49
NPC1 O15118 1/20 0.49
RAB9A P51151 1/20 0.49
THRA P10827 1/20 0.48
THRB P10828 1/20 0.48
PLA2G4B P0C869 3/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2C8 P10632 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2B6 P20813 1/20 0.44
CYP2C19 P33261 1/20 0.44
CNR2 P34972 1/20 0.44
PTGES O14684 2/20 0.43
MAPT P10636 1/20 0.43

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
SCHEMBL13412642 0.85 ALDH1A1 (0.50) ALDH1A1LMNAMTNR1AMTNR1BCNR1
SCHEMBL5315774 0.85 PTGES (0.55) ALDH1A1LMNAMTNR1AMTNR1BNPC1
SCHEMBL20495338 0.85 PTGES (0.55) ALDH1A1LMNAMTNR1AMTNR1BNPC1
SCHEMBL7260314 0.85 PTGES (0.55) ALDH1A1LMNAMTNR1AMTNR1BNPC1
SCHEMBL14838080 0.83 PTGES (0.52) ALDH1A1LMNAMTNR1AMTNR1BNPC1
SCHEMBL2452199 0.83 THRA (0.54) ALDH1A1LMNAMTNR1AMTNR1BNPC1
SCHEMBL423408 0.81 ALDH1A1 (0.51) ALDH1A1LMNAMTNR1AMTNR1BNPC1
SCHEMBL4411960 0.81 ALDH1A1 (0.57) ALDH1A1LMNAMTNR1AMTNR1BNPC1
SCHEMBL21102450 0.81 ALDH1A1 (0.57) ALDH1A1LMNAMTNR1AMTNR1BNPC1
SCHEMBL4277119 0.81 ALDH1A1 (0.57) ALDH1A1LMNAMTNR1AMTNR1BNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150330602-A1 WAVE LENGTH CONVERSION MEMBER, BACK LIGHT UNIT, LIQUID CRYSTAL DISPLAY DEVICE, AND QUANTUM DOT-CONTAINING POLYMERIZABLE COMPOSITION FUJIFILM CORPORATION (JP) 2015-11-19 US disclosed