SCHEMBL20043044

SCHEMBL20043044

B=NCCN(CCSC(c1ccccc1)(c1ccccc1)c1ccccc1)C(=O)C=C

nearest known ligand 0.38

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 19/20 0.38
SLC6A1 P30531 1/20 0.33
SLC6A11 P48066 1/20 0.33

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
SCHEMBL20043073 0.81 KIF11 (0.38) KIF11SLC6A1SLC6A11
SCHEMBL20043070 0.77 KIF11 (0.40) KIF11
SCHEMBL20043043 0.77 KIF11 (0.33) KIF11
SCHEMBL20043062 0.69 ADORA2A (0.47)
SCHEMBL6924710 0.69 KIF11 (0.54) KIF11
SCHEMBL20043040 0.68 ZDHHC20 (0.31)
SCHEMBL285335 0.65 THRB (0.53) KIF11
SCHEMBL5666943 0.65 NPC1 (0.48) KIF11
SCHEMBL4806285 0.64 KIF11 (0.46) KIF11
SCHEMBL2830189 0.63 SMN1; SMN2 (0.45) KIF11

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-20180100036-A1 CLICK NUCLEIC ACID POLYMERS AND METHODS OF USE UNIV COLORADO REGENTS (US) 2018-04-12 US disclosed