SCHEMBL5499741

SCHEMBL5499741

OC(CCl)C(O)C(Cl)C(O)CCl

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.38
TP53 P04637 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
ALDH1A1 P00352 1/20 0.35
CA1 P00915 2/20 0.30
CA2 P00918 2/20 0.30
CA9 Q16790 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
SCHEMBL32685228 0.83 TSHR (0.41) TSHRTP53TDP1ALDH1A1CA1
SCHEMBL7344387 0.79 TSHR (0.44) TSHRTP53TDP1ALDH1A1CA1
SCHEMBL7148720 0.75 MPI (0.32)
SCHEMBL28394231 0.73
SCHEMBL7990296 0.73 TSHR (0.36) TSHRTP53TDP1ALDH1A1
SCHEMBL21114488 0.71
SCHEMBL965530 0.71
SCHEMBL7169460 0.71
SCHEMBL29557438 0.71
SCHEMBL946153 0.69

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-1770109-B1 Process of preparing polyamine-epihalohydrin resins with reduced byproduct content HERCULES INC (US) 2012-08-08 EP disclosed
EP-1777247-A2 Reduced byproduct polyamidoamine-epihalohydrin resins HERCULES INCORPORATED (US) 2007-04-25 EP disclosed