SCHEMBL5897141

SCHEMBL5897141

N#Cc1cc[c]c(NCCCN2CCOCC2)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.47
ALDH1A1 P00352 8/20 0.47
HPGD P15428 6/20 0.47
HSD17B10 Q99714 6/20 0.47
EGLN2 Q96KS0 1/20 0.47
HRH2 P25021 1/20 0.45
HRH1 P35367 1/20 0.45
HRH3 Q9Y5N1 1/20 0.45
GAA P10253 6/20 0.44
GLA P06280 4/20 0.44
RAB9A P51151 4/20 0.44
NPC1 O15118 3/20 0.44
LMNA P02545 2/20 0.44
KMT2A Q03164 2/20 0.44
POLB P06746 2/20 0.44
RAD52 P43351 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
PKM P14618 3/20 0.43
RXFP1 Q9HBX9 1/20 0.42
CASP1 P29466 1/20 0.42

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
SCHEMBL996592 0.77 NPC1 (0.53) KDM4EALDH1A1HSD17B10GAAGLA
SCHEMBL1654886 0.77 EGLN2 (0.53) KDM4EALDH1A1HPGDHSD17B10EGLN2
SCHEMBL996593 0.72 RAB9A (0.50) KDM4EALDH1A1HPGDGAAGLA
SCHEMBL7525975 0.69 KMT2A (0.56) KDM4EALDH1A1HPGDHSD17B10GAA
SCHEMBL1356124 0.68 ALDH1A1 (0.46) ALDH1A1LMNAKMT2APOLBPKM
SCHEMBL6292099 0.68 NPC1 (0.49) KDM4EALDH1A1HSD17B10GAAGLA
SCHEMBL4240648 0.68 PKM (0.49) KDM4EALDH1A1HPGDHSD17B10EGLN2
SCHEMBL23702338 0.67 AR (0.42) KDM4EALDH1A1HPGDHSD17B10LMNA
SCHEMBL933304 0.67 KDM4E (0.51) KDM4EALDH1A1HSD17B10HRH3GAA
SCHEMBL5897460 0.67 RAB9A (0.54) KDM4EALDH1A1GAAGLARAB9A

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-7060700-B2 Amide derivatives useful as inhibitors of the production of cytokines ASTRAZENECA AB (SE) 2006-06-13 US disclosed