SCHEMBL16229524

SCHEMBL16229524

C=CC(=O)NCCCCCCCCCCCCC(=O)O

nearest known ligand 0.63

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ZDHHC20 Q5W0Z9 1/20 0.63
ZDHHC2 Q9UIJ5 1/20 0.63
PRMT1 Q99873 1/20 0.61
ADRA1A P35348 1/20 0.57
MAPK1 P28482 2/20 0.50
ABCC4 O15439 1/20 0.50
MAPT P10636 1/20 0.50
TGM2 P21980 1/20 0.49
TSHR P16473 2/20 0.48
LMNA P02545 1/20 0.48
NFKB1 P19838 1/20 0.48
PMP22 Q01453 1/20 0.48
EPHX2 P34913 7/20 0.47
PLA2G2A P14555 1/20 0.47
POLB P06746 1/20 0.47
ALDH1A1 P00352 1/20 0.46
TDP1 Q9NUW8 1/20 0.46

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
SCHEMBL1083120 1.00 ZDHHC20 (0.63) ZDHHC20ZDHHC2PRMT1ADRA1AMAPK1
SCHEMBL1018405 1.00 ZDHHC20 (0.63) ZDHHC20ZDHHC2PRMT1ADRA1AMAPK1
SCHEMBL1332462 1.00 ZDHHC20 (0.63) ZDHHC20ZDHHC2PRMT1ADRA1AMAPK1
SCHEMBL1015381 1.00 ZDHHC20 (0.63) ZDHHC20ZDHHC2PRMT1ADRA1AMAPK1
SCHEMBL1334526 1.00 ZDHHC20 (0.63) ZDHHC20ZDHHC2PRMT1ADRA1AMAPK1
SCHEMBL15463341 1.00 ZDHHC20 (0.63) ZDHHC20ZDHHC2PRMT1ADRA1AMAPK1
SCHEMBL1018444 1.00 ZDHHC20 (0.63) ZDHHC20ZDHHC2PRMT1ADRA1AMAPK1
SCHEMBL1018094 1.00 ZDHHC20 (0.63) ZDHHC20ZDHHC2PRMT1ADRA1AMAPK1
SCHEMBL707155 1.00 ZDHHC20 (0.63) ZDHHC20ZDHHC2PRMT1ADRA1AMAPK1
SCHEMBL1017486 1.00 ZDHHC20 (0.63) ZDHHC20ZDHHC2PRMT1ADRA1AMAPK1

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-8883877-B2 Materials based on radically polymerizable N,O-functionalized acrylic acid hydroxamides IVOCLAR VIVADENT AG (LI) 2014-11-11 US disclosed