SCHEMBL11545950

SCHEMBL11545950

COC(=O)C=Cc1ccc(OCC(O)CNc2ccc(C(C)(C)C)cc2)cc1

nearest known ligand 0.68

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.68
GAA P10253 2/20 0.68
ALDH1A1 P00352 3/20 0.53
LMNA P02545 2/20 0.53
KDM4E B2RXH2 1/20 0.53
TRPV1 Q8NER1 4/20 0.50
HTT P42858 2/20 0.49
MEN1 O00255 1/20 0.49
HPGD P15428 1/20 0.49
MAPK1 P28482 1/20 0.49
KMT2A Q03164 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.47
KDM1A O60341 1/20 0.43
CYP1A2 P05177 1/20 0.42
HDAC8 Q9BY41 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
SCHEMBL11545760 0.90 MAPT (0.66) MAPTGAAALDH1A1LMNAKDM4E
SCHEMBL11545891 0.90 MAPT (0.66) MAPTGAAALDH1A1LMNAKDM4E
SCHEMBL11547431 0.80 MAPT (0.73) MAPTGAAALDH1A1LMNAKDM4E
SCHEMBL11551464 0.78 MAPT (0.55) MAPTGAAALDH1A1LMNAKDM4E
SCHEMBL11544902 0.78 MAPT (0.55) MAPTGAAALDH1A1LMNAKDM4E
SCHEMBL11619433 0.78 LMNA (0.48) MAPTGAAALDH1A1LMNAKDM4E
SCHEMBL11543976 0.78 CYP1A2 (0.51) MAPTGAAALDH1A1LMNAKDM4E
SCHEMBL8750844 0.78 CA12 (0.53) MAPTGAAALDH1A1LMNAKDM4E
SCHEMBL846210 0.77 CYP1A2 (0.68) MAPTGAAALDH1A1LMNAKDM4E
SCHEMBL846211 0.77 CYP1A2 (0.68) MAPTGAAALDH1A1LMNAKDM4E

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
US-4144351-A ANTICHOLESTEROL KLINGE PHARMA GMBH & CO. (DE) 1979-03-13 US disclosed
US-4109013-A SUBSTITUTED PROPANOL-(2) DERIVATIVES OF HYDROXAMIC ACIDS AND THE USE THEREOF AS HYPOLIPEMIC DRUGS KLINGE PHARMA GMBH & CO. (DE) 1978-08-22 US disclosed
US-4073935-A Substituted propanol-(2)-derivatives and their nicotinic acid esters, and process for their preparation, and the use thereof as hypolipemic drugs KLINGE PHARMA GMBH & CO. (DT) 1978-02-14 US disclosed