SCHEMBL7988060

SCHEMBL7988060

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

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIRT2 Q8IXJ6 1/20 0.50
SIRT1 Q96EB6 1/20 0.50
SIRT3 Q9NTG7 1/20 0.50
MAPT P10636 6/20 0.47
TARBP2 Q15633 2/20 0.47
TP53 P04637 2/20 0.46
MDM2 Q00987 1/20 0.46
GCGR P47871 1/20 0.45
PTPN11 Q06124 1/20 0.45
ALOX5 P09917 1/20 0.43
PDCD4 Q53EL6 1/20 0.42
ACHE P22303 2/20 0.41
GABRA2 P47869 2/20 0.41
GABRB2 P47870 2/20 0.41
GABRP O00591 1/20 0.41
GABRD O14764 1/20 0.41
GABRA1 P14867 1/20 0.41
GABRB1 P18505 1/20 0.41
GABRG2 P18507 1/20 0.41
GABRB3 P28472 1/20 0.41

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
SCHEMBL7991913 0.97 SIRT2 (0.48) SIRT2SIRT1SIRT3MAPTTARBP2
SCHEMBL7988436 0.97 SIRT2 (0.48) SIRT2SIRT1SIRT3MAPTTARBP2
SCHEMBL7991299 0.95 SIRT2 (0.49) SIRT2SIRT1SIRT3MAPTTARBP2
SCHEMBL7988171 0.95 SIRT2 (0.49) SIRT2SIRT1SIRT3MAPTTARBP2
SCHEMBL7989526 0.92 SIRT2 (0.50) SIRT2SIRT1SIRT3MAPTTARBP2
SCHEMBL7988623 0.90 ALOX5 (0.52) MAPTTARBP2TP53GCGRALOX5
SCHEMBL7977741 0.89 SIRT2 (0.48) SIRT2SIRT1SIRT3MAPTTARBP2
SCHEMBL7977691 0.87 PRKAB2 (0.46) MAPTTP53GCGRACHEKDM4E
SCHEMBL7991891 0.84 PRKAB2 (0.44) MAPTTP53ACHEKDM4EALDH1A1
SCHEMBL7991760 0.84 PRKAB2 (0.44) MAPTTP53ACHEKDM4EALDH1A1

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