SCHEMBL8762014

SCHEMBL8762014

CN(C)CCC=C(CCCCCCCCCCCCCCCCCl)C(=O)O

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM4A O75164 12/20 0.36
KDM4C Q9H3R0 12/20 0.36
KDM5A P29375 1/20 0.36
KDM7A Q6ZMT4 1/20 0.36
PHF8 Q9UPP1 1/20 0.36
KDM2A Q9Y2K7 1/20 0.36
PAOX Q6QHF9 1/20 0.33
DNM1 Q05193 2/20 0.33
BCL2L1 Q07817 1/20 0.33
EPHX2 P34913 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
SCHEMBL5076402 0.85 DNM1 (0.47) DNM1EPHX2
SCHEMBL855742 0.80 BCL2L1 (0.37) BCL2L1
Chloromethane SCHEMBL9081965 0.79 GRIK1 (0.38) DNM1BCL2L1EPHX2
SCHEMBL28459710 0.79 GRIK1 (0.40) DNM1BCL2L1EPHX2
SCHEMBL5494126 0.78 GRIK1 (0.36)
SCHEMBL4164366 0.76 EP300 (0.41) DNM1EPHX2
SCHEMBL4162121 0.76 EP300 (0.41) DNM1EPHX2
SCHEMBL4172315 0.76 EP300 (0.41) DNM1EPHX2
SCHEMBL4173883 0.76 EP300 (0.41) DNM1EPHX2
SCHEMBL4164314 0.76 EP300 (0.41) DNM1EPHX2

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-0643017-B1 Hydrophobic Polyelectrolyte coagulants for concentrating coal tailings NALCO CHEMICAL CO (US) 1997-12-17 EP claimed
EP-0637598-B1 Hydrophobic dispersants used in forming polymer dispersions NALCO CHEMICAL CO (US) 1997-05-02 EP claimed