SCHEMBL4272622

SCHEMBL4272622

CCCCCCCC[Sn](OCCC(C)C)(OCCC(C)C)OCCC(C)C

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FAAH O00519 4/20 0.33
DNM1 Q05193 3/20 0.33
CNR1 P21554 1/20 0.33
CNR2 P34972 1/20 0.33
OPRM1 P35372 1/20 0.32
TSHR P16473 1/20 0.32
THRB P10828 1/20 0.32
SPHK1 Q9NYA1 1/20 0.31
TRPM8 Q7Z2W7 3/20 0.31
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30

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
SCHEMBL4268908 0.92 ALDH1A1 (0.32) OPRM1ALDH1A1
SCHEMBL2328472 0.88
SCHEMBL4269972 0.86
SCHEMBL2326341 0.84 FAAH (0.33) FAAHDNM1CNR1CNR2OPRM1
SCHEMBL2330717 0.84 FAAH (0.33) FAAHDNM1CNR1CNR2OPRM1
SCHEMBL2325610 0.81 FAAH (0.32) FAAHDNM1CNR1CNR2OPRM1
SCHEMBL4266416 0.81 THRB (0.40) TSHRTHRB
SCHEMBL4270021 0.81 THRB (0.40) TSHRTHRB
SCHEMBL4265504 0.81 THRB (0.40) TSHRTHRB
SCHEMBL4270455 0.81 THRB (0.40) TSHRTHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8362289-B2 Mixture for recovery utilization or transfer of carbon dioxide ASAHI KASEI CHEMICALS CORPORATION (JP) 2013-01-29 US disclosed
EP-2006013-B1 MIXTURE FOR CARBON DIOXIDE RECOVERY/UTILIZATION AND TRANSPORTATION ASAHI KASEI CHEMICALS CORP (JP) 2013-01-02 EP disclosed
EP-2006013-A9 MIXTURE FOR CARBON DIOXIDE RECOVERY/UTILIZATION AND TRANSPORTATION Asahi Kasei Chemicals Corporation (JP) 2009-07-22 EP disclosed
US-20090169461-A1 Mixture For Recovery Utilization Or Transfer Of Carbon Dioxide ASAHI KASEI KABUSHIKI KAISHA (JP) 2009-07-02 US disclosed
EP-2006013-A2 MIXTURE FOR CARBON DIOXIDE RECOVERY/UTILIZATION AND TRANSPORTATION Asahi Kasei Chemicals Corporation (JP) 2008-12-24 EP disclosed