SCHEMBL19787823

SCHEMBL19787823

CC(C)(S)CCOC(=O)CN

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 1/20 0.33
LMNA P02545 1/20 0.31
HSD17B10 Q99714 1/20 0.31
ADRA2A P08913 1/20 0.30
ADRA1A P35348 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
SCHEMBL16881654 0.83 HTR2C (0.35) HTR2CLMNAHSD17B10ADRA2AADRA1A
SCHEMBL1434579 0.81 GRM4 (0.35) HTR2CLMNAHSD17B10ADRA2AADRA1A
SCHEMBL4742506 0.78 DGKA (0.44) HTR2CLMNAHSD17B10ADRA2AADRA1A
SCHEMBL19387343 0.78 HTR2C (0.36) HTR2CLMNAHSD17B10
SCHEMBL18339269 0.76 MMP1 (0.36)
SCHEMBL4696007 0.76 ALDH1A1 (0.44) LMNAHSD17B10
SCHEMBL18823278 0.75 HTR2C (0.41) HTR2CLMNAHSD17B10ADRA2AADRA1A
SCHEMBL22458075 0.75 LMNA (0.31) LMNAHSD17B10
SCHEMBL23408786 0.75 HTR2C (0.34) HTR2CLMNAHSD17B10
SCHEMBL3121478 0.74 GLRA1 (0.39) HTR2CLMNAHSD17B10ADRA2AADRA1A

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-9872918-B2 Hydroxyl-polymer-drug-protein conjugates MERSANA THERAPEUTICS, INC. (US) 2018-01-23 US disclosed