SCHEMBL2335211

SCHEMBL2335211

CCC(O)O.CCC(O)O.CCC(O)O.CCC(O)O.CCC(O)O.CCC(O)O

nearest known ligand 0.58

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.58
LMNA P02545 5/20 0.36
ALDH1A1 P00352 3/20 0.36
TDP1 Q9NUW8 2/20 0.36
GAPDH P04406 1/20 0.33
CNR1 P21554 1/20 0.30
ADRA1A P35348 1/20 0.30
LAP3 P28838 1/20 0.30
KDM4E B2RXH2 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
SCHEMBL14994799 1.00 TSHR (0.58) TSHRLMNAALDH1A1TDP1GAPDH
SCHEMBL16959 1.00
Methane SCHEMBL25267970 0.95
SCHEMBL11418802 0.95 TSHR (0.54) TSHRLMNAALDH1A1TDP1GAPDH
SCHEMBL7456233 0.95
Water SCHEMBL4796024 0.95
Hydrochloric Acid SCHEMBL137610 0.95
SCHEMBL5899501 0.95
Water SCHEMBL1970384 0.95
Methyl Alcohol SCHEMBL28751111 0.95

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2475714-A1 BIOPOLYMER COMPOSITIONS HAVING IMPROVED FLEXIBILITY HallStar Innovations Corp. (US) 2012-07-18 EP disclosed
WO-2011100101-A1 BIOPOLYMER COMPOSITIONS HAVING IMPROVED FLEXIBILITY HALLSTAR INNOVATIONS CORP. (US) 2011-08-18 WO disclosed