SCHEMBL8934977

SCHEMBL8934977

CC(O)c1cc(N)cc(C(=O)NCC(O)CO)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.42
HPGD P15428 2/20 0.42
ALDH1A1 P00352 2/20 0.42
PRMT5 O14744 2/20 0.40
WDR77 Q9BQA1 1/20 0.40
GAA P10253 1/20 0.39
KMT2A Q03164 1/20 0.39
HSD17B10 Q99714 1/20 0.39
CA2 P00918 1/20 0.38
MAPK14 Q16539 1/20 0.36
EGFR P00533 1/20 0.36
SRC P12931 1/20 0.36
ACSS2 Q9NR19 2/20 0.35
LMNA P02545 1/20 0.35
CYP2C19 P33261 1/20 0.35
HIF1A Q16665 1/20 0.35
LOX P28300 2/20 0.35
LOXL2 Q9Y4K0 2/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35

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
SCHEMBL8380052 0.88 KDM4E (0.44) KDM4EHPGDALDH1A1PRMT5WDR77
SCHEMBL905517 0.88 KDM4E (0.48) KDM4EHPGDALDH1A1PRMT5WDR77
SCHEMBL7590944 0.87 KDM4E (0.43) KDM4EHPGDALDH1A1PRMT5WDR77
Hydrochloric Acid SCHEMBL1116045 0.86 KDM4E (0.47) KDM4EHPGDALDH1A1PRMT5WDR77
SCHEMBL26370768 0.84 KDM4E (0.41) KDM4EHPGDALDH1A1PRMT5WDR77
SCHEMBL30129826 0.82 KDM4E (0.44) KDM4EHPGDALDH1A1PRMT5WDR77
SCHEMBL3878826 0.82 KDM4E (0.44) KDM4EHPGDALDH1A1PRMT5WDR77
SCHEMBL13639964 0.82 GAA (0.44) KDM4EHPGDALDH1A1PRMT5WDR77
SCHEMBL7592569 0.81 KDM4E (0.43) KDM4EHPGDALDH1A1PRMT5WDR77
SCHEMBL9563079 0.81 NTRK2 (0.44) KDM4EHPGDALDH1A1PRMT5WDR77

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-5575905-A Iodination process NYCOMED IMAGING AS (NO) 1996-11-19 US claimed