SCHEMBL7989867

SCHEMBL7989867

CCOC(=O)c1nc(-c2ccc(N3CCCC3)cc2)[nH]c1-c1ccc(OC)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIRT2 Q8IXJ6 3/20 0.58
SIRT1 Q96EB6 3/20 0.58
CHEK2 O96017 1/20 0.49
TARBP2 Q15633 2/20 0.48
PDCD4 Q53EL6 1/20 0.48
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
MAPT P10636 3/20 0.47
GAA P10253 2/20 0.46
POLB P06746 1/20 0.46
TP53 P04637 1/20 0.46
PRKD3 O94806 1/20 0.44
MAP4K4 O95819 1/20 0.44
PIM1 P11309 1/20 0.44
CLK2 P49760 1/20 0.44
MAP4K2 Q12851 1/20 0.44
CAMK2D Q13557 1/20 0.44
DYRK1A Q13627 1/20 0.44
PIM3 Q86V86 1/20 0.44
AURKB Q96GD4 1/20 0.44

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
SCHEMBL7988152 0.91 SIRT2 (0.61) SIRT2SIRT1TARBP2MEN1KMT2A
SCHEMBL7991809 0.89 SIRT2 (0.59) SIRT2SIRT1TARBP2MAPTTP53
SCHEMBL7987913 0.89 SIRT2 (0.59) SIRT2SIRT1CHEK2MEN1KMT2A
SCHEMBL7978031 0.88 SIRT2 (0.61) SIRT2SIRT1CHEK2MEN1KMT2A
SCHEMBL7989667 0.88 SIRT2 (0.61) SIRT2SIRT1TARBP2MAPTTP53
SCHEMBL7977935 0.86 CHEK2 (0.53) SIRT2SIRT1CHEK2MEN1KMT2A
SCHEMBL7989515 0.82 SIRT2 (0.52) SIRT2SIRT1TARBP2MEN1KMT2A
SCHEMBL7977895 0.81 SIRT2 (0.61) SIRT2SIRT1TARBP2MAPTGAA
SCHEMBL7977730 0.81 SIRT2 (0.50) SIRT2SIRT1TARBP2MEN1KMT2A
SCHEMBL7989978 0.81 SIRT2 (0.61) SIRT2SIRT1CHEK2MAPTPOLB

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