SCHEMBL9473136

SCHEMBL9473136

C=C(C)C(=O)CCNC(=O)NC

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 1/20 0.37
NFE2L2 Q16236 1/20 0.37
KMT2A Q03164 1/20 0.34
MTNR1A P48039 3/20 0.33
HSD17B10 Q99714 1/20 0.32
MTNR1B P49286 1/20 0.31
EPHX1 P07099 2/20 0.30
ALDH1A1 P00352 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
SCHEMBL21845015 0.80 KDM4E (0.48) KMT2AMTNR1AMTNR1BALDH1A1
SCHEMBL28520089 0.80 BBOX1 (0.31)
SCHEMBL13205118 0.78 PLA2G2A (0.36) ALDH1A1
SCHEMBL24109495 0.78 ALDH1A1 (0.43) KEAP1NFE2L2KMT2AMTNR1AHSD17B10
SCHEMBL19411349 0.78
SCHEMBL12587309 0.77 EPHX1 (0.50) KMT2AHSD17B10EPHX1ALDH1A1
SCHEMBL9011086 0.77 TDP1 (0.40) ALDH1A1
SCHEMBL10018100 0.75 EPHX1 (0.44) KMT2AMTNR1AMTNR1BEPHX1ALDH1A1
SCHEMBL8549199 0.75 KEAP1 (0.37) KEAP1NFE2L2KMT2AMTNR1AHSD17B10
SCHEMBL13853553 0.75 LMNA (0.48) KEAP1NFE2L2KMT2AMTNR1AHSD17B10

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-5270412-A Dispersion polymers which contain urea groups and are based on ethylenically unsaturated monomers, process for their preparation and their use HOECHST AKTIENGESELLSCHAFT (DE) 1993-12-14 US disclosed
US-5045616-A Disperson polymers which contain urea groups and are based on ethylenically unsaturated monomers, process for their preparation and their use HOECHST AG (DE) 1991-09-03 US disclosed