Ether

Ether

SCHEMBL17045842

CCOCC.[Li]C(CCC)CCCCCCCCC

nearest known ligand 0.39

Full drug profile on Sugi Atlas →

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.39
LMNA P02545 1/20 0.37
DNM1 Q05193 2/20 0.36
TSHR P16473 1/20 0.35
THRB P10828 1/20 0.35
SMPD1 P17405 3/20 0.34
GPR84 Q9NQS5 3/20 0.33
FDPS P14324 3/20 0.33
ZDHHC7 Q9NXF8 1/20 0.33
SPHK1 Q9NYA1 1/20 0.33
FFAR1 O14842 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
SCHEMBL5067840 0.89 TSHR (0.44) OPRM1LMNADNM1TSHRTHRB
SCHEMBL28287650 0.89 TSHR (0.44) OPRM1LMNADNM1TSHRTHRB
SCHEMBL16926996 0.89 TSHR (0.44) OPRM1LMNADNM1TSHRTHRB
SCHEMBL8067844 0.86 OPRM1 (0.43) OPRM1LMNADNM1TSHRTHRB
SCHEMBL11327130 0.83 TSHR (0.50) OPRM1LMNADNM1TSHRTHRB
SCHEMBL5819405 0.81 OPRM1 (0.48) OPRM1LMNADNM1TSHRTHRB
SCHEMBL263101 0.78
Decane SCHEMBL8911918 0.75 TSHR (0.61) LMNADNM1TSHRTHRB
Heptane SCHEMBL7471083 0.75 TSHR (0.61) LMNADNM1TSHRTHRB
Octane SCHEMBL3363318 0.75 TSHR (0.61) LMNADNM1TSHRTHRB

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-9331282-B2 Conjugated polymer, and electron donating organic material, material for photovoltaic device and photovoltaic device using the conjugated polymer TORAY INDUSTRIES, INC. (JP) 2016-05-03 US disclosed
US-20150249214-A1 CONJUGATED POLYMER, AND ELECTRON DONATING ORGANIC MATERIAL, MATERIAL FOR PHOTOVOLTAIC DEVICE AND PHOTOVOLTAIC DEVICE USING THE CONJUGATED POLYMER TORAY INDUSTRIES, INC. (JP) 2015-09-03 US disclosed
CN-104640902-A Conjugated polymer, and electron-donating organic material, photovoltaic element material and photovoltaic element comprising same TORAY INDUSTRIES 2015-05-20 CN disclosed