SCHEMBL4266099

SCHEMBL4266099

CCCCCO[Sn](CCCC)(CCCC)CCCC

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 2/20 0.35
TSHR P16473 1/20 0.35
CA1 P00915 9/20 0.34
CA2 P00918 9/20 0.34
CA9 Q16790 9/20 0.34
CA12 O43570 4/20 0.34
MEN1 O00255 1/20 0.34
HTT P42858 1/20 0.34
KMT2A Q03164 1/20 0.34
MAPT P10636 1/20 0.34
LPAR3 Q9UBY5 6/20 0.33
LPAR2 Q9HBW0 5/20 0.33
LPAR1 Q92633 2/20 0.33
CA3 P07451 2/20 0.33
CA4 P22748 2/20 0.33
CA6 P23280 2/20 0.33
CA5A P35218 2/20 0.33
CA7 P43166 2/20 0.33
CA14 Q9ULX7 2/20 0.33
CA5B Q9Y2D0 2/20 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
SCHEMBL4277356 0.97 THRB (0.40) THRBTSHRCA1CA2CA9
SCHEMBL4267258 0.97 THRB (0.40) THRBTSHRCA1CA2CA9
SCHEMBL2325273 0.95 CA1 (0.32) THRBTSHRCA1CA2CA9
SCHEMBL2325312 0.95 CA1 (0.32) THRBTSHRCA1CA2CA9
SCHEMBL2326830 0.93 THRB (0.36) THRBTSHRCA1CA2CA9
SCHEMBL2328047 0.93 THRB (0.36) THRBTSHRCA1CA2CA9
SCHEMBL2329632 0.93 THRB (0.36) THRBTSHRCA1CA2CA9
SCHEMBL2326135 0.93 THRB (0.36) THRBTSHRCA1CA2CA9
SCHEMBL2325917 0.93 THRB (0.36) THRBTSHRCA1CA2CA9
SCHEMBL2329190 0.93 THRB (0.36) THRBTSHRCA1CA2CA9

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