SCHEMBL7150408

SCHEMBL7150408

[CH]=Cc1cc(OCCCCCCCCCCCC)[c]cc1OC

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SMPD1 P17405 3/20 0.35
SRC P12931 1/20 0.34
S1PR2 O95136 1/20 0.34
S1PR1 P21453 1/20 0.34
S1PR3 Q99500 1/20 0.34
LPAR2 Q9HBW0 1/20 0.34

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
SCHEMBL8508182 1.00 SMPD1 (0.35) SMPD1SRCS1PR2S1PR1S1PR3
SCHEMBL7043526 0.92 THRB (0.34) SMPD1S1PR2S1PR1S1PR3LPAR2
SCHEMBL4555922 0.92 THRB (0.34) SMPD1S1PR2S1PR1S1PR3LPAR2
SCHEMBL2198964 0.92 THRB (0.34) SMPD1S1PR2S1PR1S1PR3LPAR2
SCHEMBL3278113 0.92 THRB (0.34) SMPD1S1PR2S1PR1S1PR3LPAR2
SCHEMBL3870906 0.78 KDM4E (0.31)
SCHEMBL1286457 0.78
SCHEMBL9166403 0.77
SCHEMBL6935822 0.77 AHR (0.36) SMPD1
SCHEMBL364378 0.77 ALOX5 (0.32)

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-6528942-B1 Organic electroluminescence device, its manufacturing method and board for display device used therefor ROHM CO., LTD. (JP) 2003-03-04 US disclosed