SCHEMBL4270246

SCHEMBL4270246

CCCCCCCC[Sn](CCCCCCCC)(CCCCCCCC)OCCCC

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 2/20 0.40
TSHR P16473 1/20 0.40
ADRB2 P07550 1/20 0.36
ADRB1 P08588 1/20 0.36
ADRB3 P13945 1/20 0.36
MEN1 O00255 1/20 0.33
HTT P42858 1/20 0.33
KMT2A Q03164 1/20 0.33
NR5A1 Q13285 1/20 0.33
MAPT P10636 1/20 0.33
LPAR3 Q9UBY5 6/20 0.32
CA1 P00915 6/20 0.32
CA2 P00918 6/20 0.32
CA9 Q16790 6/20 0.32
LPAR2 Q9HBW0 5/20 0.32
LPAR1 Q92633 2/20 0.32
CA12 O43570 2/20 0.32
CA3 P07451 2/20 0.32
CA4 P22748 2/20 0.32
CA6 P23280 2/20 0.32

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
SCHEMBL4270829 0.95 THRB (0.40) THRBTSHRMEN1HTTKMT2A
SCHEMBL4268282 0.95 THRB (0.40) THRBTSHRMEN1HTTKMT2A
SCHEMBL4270467 0.95 THRB (0.40) THRBTSHRMEN1HTTKMT2A
SCHEMBL4267258 0.90 THRB (0.40) THRBTSHRMEN1HTTKMT2A
SCHEMBL4269738 0.90 TSHR (0.40) THRBTSHRMEN1HTTKMT2A
SCHEMBL4277356 0.90 THRB (0.40) THRBTSHRMEN1HTTKMT2A
SCHEMBL2326531 0.90 ADRB2 (0.39) THRBTSHRADRB2ADRB1ADRB3
SCHEMBL4266099 0.87 THRB (0.35) THRBTSHRMEN1HTTKMT2A
SCHEMBL2321349 0.86 THRB (0.36) THRBTSHRMEN1HTTKMT2A
SCHEMBL2330044 0.86 THRB (0.36) THRBTSHRMEN1HTTKMT2A

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