SCHEMBL7989520

SCHEMBL7989520

CCOC(=O)c1nc(-c2ccc(CN3CCOCC3)cc2)[nH]c1-c1ccc(Cl)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 1/20 0.51
PARP1 P09874 1/20 0.49
ERCC1 P07992 1/20 0.48
FEN1 P39748 1/20 0.48
ERCC4 Q92889 1/20 0.48
SIRT2 Q8IXJ6 2/20 0.48
SIRT1 Q96EB6 2/20 0.48
ALOX5 P09917 1/20 0.48
TSHR P16473 2/20 0.48
RAB9A P51151 2/20 0.48
LMNA P02545 1/20 0.48
MAPT P10636 1/20 0.48
MAPK1 P28482 1/20 0.48
STAT3 P40763 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
HDAC3 O15379 1/20 0.47
HDAC1 Q13547 1/20 0.47
HDAC2 Q92769 1/20 0.47
HDAC8 Q9BY41 1/20 0.47
HDAC6 Q9UBN7 1/20 0.47

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
SCHEMBL7989055 0.92 SIRT2 (0.46) SLC2A1PARP1ERCC1FEN1ERCC4
SCHEMBL7977895 0.88 SIRT2 (0.61) SLC2A1PARP1SIRT2SIRT1ALOX5
SCHEMBL7988555 0.86 PARP1 (0.54) PARP1ERCC1FEN1ERCC4ALOX5
SCHEMBL7991809 0.82 SIRT2 (0.59) SIRT2SIRT1ALOX5RAB9AMAPT
SCHEMBL7991536 0.82 SIRT2 (0.52) SLC2A1SIRT2SIRT1ALOX5LMNA
SCHEMBL7989667 0.81 SIRT2 (0.61) SIRT2SIRT1ALOX5RAB9AMAPT
SCHEMBL7977730 0.80 SIRT2 (0.50) SIRT2SIRT1ALOX5MAPTSMN1; SMN2
SCHEMBL7990035 0.80 SIRT2 (0.46) SIRT2SIRT1ALOX5RAB9AMAPT
SCHEMBL7989599 0.80 SIRT2 (0.52) PARP1ERCC1FEN1ERCC4SIRT2
SCHEMBL7989731 0.80 SIRT2 (0.49) SIRT2SIRT1ALOX5RAB9ALMNA

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-6288061-B1 INTERLEUKIN INHIBITORS; ASTHMA, BRONCHODILATOR AGENTS, ANTIALLERGENS WELFIDE CORPORATION (JP) 2001-09-11 US disclosed