SCHEMBL23769753

SCHEMBL23769753

CCCCCCCCCCCCCCCCN(CCO)CCCCCCCC(=O)OC(CCCCCCCC)CCCCCCCC

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 5/20 0.58
MAPT P10636 4/20 0.58
LMNA P02545 6/20 0.51
PRKCA P17252 2/20 0.51
PRKCE Q02156 2/20 0.51
PRKCQ Q04759 2/20 0.51
PRKCD Q05655 2/20 0.51
ALDH1A1 P00352 1/20 0.51
GMNN O75496 3/20 0.45
NPSR1 Q6W5P4 3/20 0.45
CYP1A2 P05177 2/20 0.45
MEN1 O00255 2/20 0.45
HSP90AA1 P07900 2/20 0.45
BLM P54132 2/20 0.45
KMT2A Q03164 2/20 0.45
NR1H4 Q96RI1 2/20 0.45
TP53 P04637 2/20 0.45
TSHR P16473 2/20 0.45
CYP2C9 P11712 1/20 0.45
HIF1A Q16665 1/20 0.45

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
SCHEMBL21842903 1.00 MAPK1 (0.58) MAPK1MAPTLMNAPRKCAPRKCE
SCHEMBL24163833 1.00 MAPK1 (0.58) MAPK1MAPTLMNAPRKCAPRKCE
SCHEMBL22648920 1.00 MAPK1 (0.58) MAPK1MAPTLMNAPRKCAPRKCE
SCHEMBL22646099 1.00 MAPK1 (0.58) MAPK1MAPTLMNAPRKCAPRKCE
SCHEMBL23343368 1.00 MAPK1 (0.58) MAPK1MAPTLMNAPRKCAPRKCE
SCHEMBL25411427 1.00 MAPK1 (0.58) MAPK1MAPTLMNAPRKCAPRKCE
SCHEMBL25410411 1.00 MAPK1 (0.58) MAPK1MAPTLMNAPRKCAPRKCE
SCHEMBL24164561 1.00 MAPK1 (0.58) MAPK1MAPTLMNAPRKCAPRKCE
SCHEMBL22646075 1.00 MAPK1 (0.58) MAPK1MAPTLMNAPRKCAPRKCE
SCHEMBL22515603 1.00 MAPK1 (0.58) MAPK1MAPTLMNAPRKCAPRKCE

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
EP-3458590-B9 POLYNUCLEOTIDES ENCODING -GALACTOSIDASE A FOR THE TREATMENT OF FABRY DISEASE MODERNATX INC (US) 2021-08-18 EP disclosed