SCHEMBL22374265

SCHEMBL22374265

CC(C)n1c(=O)n(C(C)C)c(=O)n(C(C)I)c1=O

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.34
HCRTR1 O43613 1/20 0.34
ALDH1A1 P00352 1/20 0.34
GAA P10253 1/20 0.34
MAPT P10636 1/20 0.34
TDP1 Q9NUW8 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
SCHEMBL1318483 0.85 ALDH1A1 (0.42) KDM4EHCRTR1ALDH1A1GAAMAPT
SCHEMBL23559808 0.79 POLB (0.40) KDM4EHCRTR1ALDH1A1GAAMAPT
SCHEMBL21787983 0.74 ADORA2B (0.41) KDM4EHCRTR1ALDH1A1GAAMAPT
SCHEMBL21082580 0.72 KDM4E (0.34) KDM4EHCRTR1ALDH1A1GAAMAPT
SCHEMBL25061686 0.72 ALDH1A1 (0.44) KDM4EHCRTR1ALDH1A1GAAMAPT
SCHEMBL12157011 0.69 ADORA2B (0.41) KDM4EHCRTR1ALDH1A1GAAMAPT
SCHEMBL22404404 0.69 TSHR (0.34) KDM4EHCRTR1ALDH1A1GAAMAPT
SCHEMBL23008456 0.69 KDM4E (0.32) KDM4EHCRTR1ALDH1A1GAAMAPT
SCHEMBL24217724 0.67 KDM4E (0.31) KDM4EHCRTR1ALDH1A1GAAMAPT
SCHEMBL18803330 0.67 KDM4E (0.34) KDM4EHCRTR1ALDH1A1GAAMAPT

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
US-11760828-B2 Two-component system for elastic coatings COVESTRO DEUTSCHLAND AG (DE) 2023-09-19 US disclosed
US-20200270390-A1 TWO-COMPONENT SYSTEM FOR ELASTIC COATINGS COVESTRO DEUTSCHLAND AG (DE) 2020-08-27 US disclosed