SCHEMBL9719047

SCHEMBL9719047

COc1cc(C2CCC(c3cc(OC)c(OC)c(OC)c3)C2=O)cc(OC)c1OC

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PTAFR P25105 2/20 0.55
LMNA P02545 1/20 0.49
ALDH1A1 P00352 2/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
MAPT P10636 5/20 0.47
TSHR P16473 1/20 0.47
PTPN1 P18031 1/20 0.47
ACHE P22303 1/20 0.47
KMT2A Q03164 4/20 0.46
MEN1 O00255 2/20 0.46
HPGD P15428 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.45

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
SCHEMBL9719064 1.00 PTAFR (0.55) PTAFRLMNAALDH1A1SMN1; SMN2MAPT
SCHEMBL9719028 1.00 PTAFR (0.55) PTAFRLMNAALDH1A1SMN1; SMN2MAPT
SCHEMBL9719012 0.81 ALDH1A1 (0.53) PTAFRALDH1A1SMN1; SMN2MAPTKMT2A
SCHEMBL9768119 0.79 PTAFR (0.53) PTAFRLMNAALDH1A1SMN1; SMN2MAPT
SCHEMBL9719071 0.79 PTAFR (0.47) PTAFR
SCHEMBL9719894 0.79 PTAFR (0.37) PTAFRLMNAALDH1A1SMN1; SMN2MAPT
SCHEMBL9719042 0.79 PTAFR (0.47) PTAFR
SCHEMBL9767997 0.78 PTAFR (0.46) PTAFR
SCHEMBL28414869 0.78 PTAFR (0.51) PTAFRLMNAALDH1A1SMN1; SMN2MAPT
SCHEMBL9724040 0.77 PTAFR (0.50) PTAFRLMNAALDH1A1SMN1; SMN2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5132463-A Cardiovascular, skin, kidney, respiratory system, and gastrointestinal disorders MERCK & CO., INC. (US) 1992-07-21 US disclosed
EP-0257921-B1 NEW 1,3-DIARYL CYCLOPENTANES AND DERIVATIVES THEREOF AS PAF ANTAGONISTS MERCK & CO. INC. (US) 1992-04-15 EP disclosed
US-5047420-A Platelet activating factor MERCK & CO., INC. (US) 1991-09-10 US disclosed
US-4845129-A ANTICOAGULANT SANDOZ PHARM. CORP. (US) 1989-07-04 US disclosed
EP-0257921-A2 New 1,3-diaryl cyclopentanes and derivatives thereof as paf antagonists MERCK & CO. INC. (US) 1988-03-02 EP disclosed