SCHEMBL9149236

SCHEMBL9149236

CCOC(=O)CC(OCCCCCCc1ccc(OC)cc1)c1cccc2c(=O)c3cc(C(=O)OC)ccc3oc12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.39
LTB4R Q15722 2/20 0.39
TTR P02766 1/20 0.37
ALDH1A1 P00352 2/20 0.36
KDM4E B2RXH2 1/20 0.36
GAA P10253 1/20 0.36
HPGD P15428 1/20 0.36
GPR35 Q9HC97 1/20 0.35
CHRNB2 P17787 1/20 0.35
CHRNA4 P43681 1/20 0.35
THRB P10828 1/20 0.35
NPC1 O15118 1/20 0.35
ASAH1 Q13510 1/20 0.35
TSHR P16473 1/20 0.35
ABCB1 P08183 2/20 0.34
ABCG2 Q9UNQ0 2/20 0.34
ABCC1 P33527 1/20 0.34
CYP2C9 P11712 1/20 0.34
MDH1 P40925 1/20 0.34
BCHE P06276 1/20 0.34

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
SCHEMBL9150905 0.84 LTB4R (0.45) MAPTLTB4RTTRALDH1A1KDM4E
SCHEMBL9149226 0.79 LTB4R (0.58) MAPTLTB4RALDH1A1KDM4EHPGD
SCHEMBL9150794 0.79 TTR (0.44) MAPTTTRALDH1A1KDM4EGAA
SCHEMBL9149095 0.74 TTR (0.46) MAPTTTRALDH1A1KDM4EGAA
SCHEMBL9150025 0.73 LTB4R (0.44) MAPTLTB4RALDH1A1KDM4EGAA
SCHEMBL9150792 0.71 LTB4R (0.45) LTB4RTTRALDH1A1KDM4EGAA
SCHEMBL9147978 0.70 LTB4R (0.45) MAPTLTB4RTTRALDH1A1KDM4E
SCHEMBL9150347 0.68 LTB4R (0.76) MAPTLTB4RALDH1A1KDM4EHPGD
SCHEMBL9150723 0.66 LTB4R (0.76) LTB4RALDH1A1KDM4EHPGDCYP2C9
SCHEMBL9150788 0.66 LTB4R (0.47) MAPTLTB4RTTRALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0442748-B1 Improvements in and relating to leukotriene antagonists LILLY CO ELI (US) 1995-01-11 EP disclosed
EP-0442748-A1 Improvements in and relating to leukotriene antagonists ELI LILLY AND COMPANY (US) 1991-08-21 EP disclosed
US-4996230-A Antiallergens, antiinflammatory agent ELI LILLY AND COMPANY (US) 1991-02-26 US disclosed