Carbon Dioxide

Carbon Dioxide

SCHEMBL8620975

CCCC[Sn](Cl)(Cl)CCCC.O=C=O

nearest known ligand 0.32

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Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.32
TDP1 Q9NUW8 1/20 0.32
LMNA P02545 1/20 0.32
ALDH1A1 P00352 1/20 0.31
TP53 P04637 1/20 0.31
THRB P10828 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
SCHEMBL9232296 0.90
SCHEMBL37123 0.88 TSHR (0.40) TSHRTDP1LMNAALDH1A1TP53
Water SCHEMBL28850770 0.85 TSHR (0.38) TSHRTDP1LMNAALDH1A1THRB
Hydrochloric Acid SCHEMBL28304571 0.85 TSHR (0.38) TSHRTDP1LMNAALDH1A1THRB
SCHEMBL18528455 0.82 TSHR (0.35) TSHRTDP1LMNAALDH1A1THRB
Methyl Alcohol SCHEMBL28075362 0.82 TSHR (0.35) TSHRTDP1LMNAALDH1A1TP53
Bromide SCHEMBL9580196 0.82 TSHR (0.35) TSHRTDP1LMNAALDH1A1TP53
SCHEMBL11802788 0.82 TSHR (0.35) TSHRTDP1LMNAALDH1A1THRB
Cyclohexane SCHEMBL9235145 0.80 CYP1A2 (0.35) TSHRTDP1LMNAALDH1A1THRB
SCHEMBL9641770 0.79 TSHR (0.44) TSHRTDP1LMNAALDH1A1THRB

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
EP-0841356-A1 Synthesis of multiblock polymers using group IIA and IIB metal cyclic organometallic initiators Bridgestone Corporation (JP) 1998-05-13 EP disclosed