SCHEMBL20043040

SCHEMBL20043040

B=NCCN(CCS)C(=O)C=C

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ZDHHC20 Q5W0Z9 1/20 0.31
ZDHHC2 Q9UIJ5 1/20 0.31

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
SCHEMBL18382214 0.69
SCHEMBL9074353 0.68 ZDHHC20 (0.31) ZDHHC20ZDHHC2
SCHEMBL20043042 0.67 ALDH1A1 (0.40)
SCHEMBL8973656 0.66 ZDHHC20 (0.41) ZDHHC20ZDHHC2
SCHEMBL34620 0.65 ZDHHC20 (0.39) ZDHHC20ZDHHC2
SCHEMBL27677055 0.65
SCHEMBL20043056 0.65
SCHEMBL22984190 0.63 ZDHHC20 (0.38) ZDHHC20ZDHHC2
SCHEMBL10485732 0.63 ZDHHC20 (0.38) ZDHHC20ZDHHC2
SCHEMBL36287 0.63 ZDHHC20 (0.50) ZDHHC20ZDHHC2

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