SCHEMBL9419741

SCHEMBL9419741

COc1ccc2c(c1)CCC(=COC(=O)c1ccccc1)C2=O

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MIF P14174 5/20 0.62
SMN1; SMN2 Q16637 5/20 0.58
MAPT P10636 4/20 0.58
LMNA P02545 3/20 0.58
ALDH1A1 P00352 3/20 0.58
KDM4E B2RXH2 2/20 0.58
GAA P10253 1/20 0.58
HTT P42858 1/20 0.58
CYP26A1 O43174 3/20 0.56
CYP27A1 Q02318 2/20 0.55
ABCB1 P08183 1/20 0.55
CYP24A1 Q07973 3/20 0.55
NPC1 O15118 4/20 0.54
RAB9A P51151 4/20 0.54
MEN1 O00255 2/20 0.54
KMT2A Q03164 2/20 0.54
HPGD P15428 2/20 0.53
MAOB P27338 2/20 0.52
NFKB1 P19838 1/20 0.52
NFKB2 Q00653 1/20 0.52

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
SCHEMBL9446419 0.90 MIF (0.52) MIFSMN1; SMN2MAPTLMNAALDH1A1
SCHEMBL8991660 0.83 MAOB (0.54) MIFSMN1; SMN2MAPTALDH1A1NPC1
SCHEMBL7517262 0.79 MIF (0.66) MIFSMN1; SMN2MAPTLMNAALDH1A1
SCHEMBL7158711 0.79 MIF (0.74) MIFSMN1; SMN2MAPTLMNAALDH1A1
SCHEMBL2872982 0.79 MIF (0.74) MIFSMN1; SMN2MAPTLMNAALDH1A1
SCHEMBL14061927 0.78 MIF (0.65) MIFSMN1; SMN2MAPTLMNAALDH1A1
SCHEMBL4975289 0.78 MIF (0.65) MIFSMN1; SMN2MAPTLMNAALDH1A1
SCHEMBL14137061 0.78 MIF (0.65) MIFSMN1; SMN2MAPTLMNAALDH1A1
SCHEMBL8169116 0.77 MIF (1.00) MIFSMN1; SMN2MAPTLMNAALDH1A1
SCHEMBL8169114 0.77 MIF (1.00) MIFSMN1; SMN2MAPTLMNAALDH1A1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101602671-B Method for synthesizing (cis)-(6-methoxyl-1-carbonyl-3,4 dihydronaphthyl-2(1H)-ylidene) methyl benzoate JIANGSU ZHONGDAN PHARMACEUTICAL RES COMPANY LTD 2012-06-27 CN disclosed
CN-101602671-A The synthetic method of (cis)-(6-methoxyl group-1-carbonyl-3,4 dihydro naphthyl-2 (1H)-subunit) methyl benzoate JIANGSU ZHONGDAN PHARMACEUTICA (CN) 2009-12-16 CN disclosed
US-5296508-A Anticholesterol agents for cardiovascular disorders BRISTOL-MYERS SQUIBB COMPANY (US) 1994-03-22 US disclosed
US-5204373-A Anticholesterol agents BRISTOL-MYERS SQUIBB COMPANY (US) 1993-04-20 US disclosed