SCHEMBL16638165

SCHEMBL16638165

COC(=O)C(Br)CC(CC(CCCC(CC(CC(Br)C(=O)OC)C(=O)OC)C(=O)OC)C(=O)OC)C(=O)OC

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ZDHHC7 Q9NXF8 1/20 0.50
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
KMT2A Q03164 1/20 0.33
BIRC2 Q13490 4/20 0.32
FOLH1 Q04609 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.31
MME P08473 1/20 0.31
KISS1R Q969F8 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
SCHEMBL16638169 0.81 ZDHHC7 (0.42) ZDHHC7CA1CA2KMT2ASMN1; SMN2
SCHEMBL25626565 0.79 ZDHHC7 (0.49) ZDHHC7CA1CA2KMT2A
SCHEMBL719382 0.79 ZDHHC7 (0.73) ZDHHC7CA1CA2KMT2ASMN1; SMN2
SCHEMBL13248927 0.79 ZDHHC7 (0.73) ZDHHC7CA1CA2KMT2ASMN1; SMN2
SCHEMBL13069761 0.79 ZDHHC7 (0.73) ZDHHC7CA1CA2KMT2ASMN1; SMN2
SCHEMBL1415280 0.79 ZDHHC7 (0.54) ZDHHC7CA1CA2KMT2ASMN1; SMN2
SCHEMBL12757785 0.79 ZDHHC7 (0.57) ZDHHC7CA1CA2BIRC2
SCHEMBL1415798 0.74 ZDHHC7 (0.80) ZDHHC7CA1CA2KMT2ABIRC2
SCHEMBL14163024 0.74 CA1 (0.50) ZDHHC7CA1CA2BIRC2FOLH1
SCHEMBL5965786 0.74 ZDHHC7 (0.65) ZDHHC7CA1CA2KMT2ASMN1; SMN2

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
US-9006362-B2 Controlled radical polymerization of (meth)acrylate monomers Henkel IP & Holding GmbH (DE) 2015-04-14 US disclosed