SCHEMBL9028841

SCHEMBL9028841

C=C(C)COc1cccc(C(C)C)c1

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.51
TSHR P16473 1/20 0.51
LMNA P02545 2/20 0.48
ALDH1A1 P00352 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
FFAR1 O14842 1/20 0.44
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
PKM P14618 1/20 0.41
GPR174 Q9BXC1 1/20 0.40
SPHK1 Q9NYA1 1/20 0.40
PTGES O14684 1/20 0.40
ALOX5 P09917 1/20 0.40
PPARG P37231 1/20 0.40
PPARA Q07869 1/20 0.40
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
GRM2 Q14416 1/20 0.39

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
SCHEMBL9622079 0.84 LMNA (0.52) KDM4ETSHRLMNAALDH1A1SMN1; SMN2
SCHEMBL9121600 0.83 KDM4E (0.55) KDM4ETSHRLMNAALDH1A1SMN1; SMN2
SCHEMBL9122374 0.81 KDM4E (0.49) KDM4ETSHRLMNAALDH1A1SMN1; SMN2
SCHEMBL9122369 0.81 KDM4E (0.49) KDM4ETSHRLMNAALDH1A1SMN1; SMN2
SCHEMBL5517321 0.80 LMNA (0.63) KDM4ETSHRLMNAALDH1A1SMN1; SMN2
SCHEMBL12035988 0.79 RAB9A (0.51) KDM4ETSHRALDH1A1MEN1KMT2A
SCHEMBL6474592 0.79 KDM4E (0.57) KDM4ETSHRLMNAALDH1A1SMN1; SMN2
Hydrochloric Acid SCHEMBL5763332 0.79 FFAR1 (0.61) KDM4ETSHRLMNAALDH1A1SMN1; SMN2
SCHEMBL4854282 0.79 KDM4E (0.53) KDM4ETSHRLMNAALDH1A1SMN1; SMN2
SCHEMBL5763328 0.79 KDM4E (0.53) KDM4ETSHRLMNAALDH1A1SMN1; SMN2

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-0445827-B1 4-Hydroxytetrahydropyran-2-one derivatives useful as cholesterol and lipid reducing agents FUJIREBIO KK (JP) 1996-09-25 EP disclosed
US-5149834-A Anticholesterol agent and enzyme inhibitors, for curing arteriosclerosis FUJIREBIO INC. (JP) 1992-09-22 US disclosed
EP-0445827-A2 4-Hydroxytetrahydropyran-2-one derivatives useful as cholesterol and lipid reducing agents FUJIREBIO INC. (JP) 1991-09-11 EP disclosed