SCHEMBL8046256

SCHEMBL8046256

C=CCOc1ccc(-c2cnc(-c3ccc(C=CCCCC(C)OCCCCC)cc3)cn2)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.37
ALDH1A1 P00352 5/20 0.37
HPGD P15428 5/20 0.37
L3MBTL1 Q9Y468 3/20 0.37
HTT P42858 1/20 0.37
CYP2D6 P10635 4/20 0.36
CYP19A1 P11511 4/20 0.36
CYP2C9 P11712 3/20 0.36
CYP2C19 P33261 3/20 0.36
RAB9A P51151 6/20 0.34
NPC1 O15118 5/20 0.34
MAPT P10636 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
TP53 P04637 1/20 0.34
ABCG2 Q9UNQ0 1/20 0.33
CASP3 P42574 2/20 0.32
SENP8 Q96LD8 2/20 0.32
SENP7 Q9BQF6 2/20 0.32
SENP6 Q9GZR1 2/20 0.32
CYP1A2 P05177 2/20 0.32

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
SCHEMBL8046254 1.00 KDM4E (0.37) KDM4EALDH1A1HPGDL3MBTL1HTT
SCHEMBL8054061 0.94 KDM4E (0.41) KDM4EALDH1A1HPGDL3MBTL1HTT
SCHEMBL8054064 0.94 KDM4E (0.41) KDM4EALDH1A1HPGDL3MBTL1HTT
SCHEMBL8046450 0.94 KDM4E (0.39) KDM4EALDH1A1HPGDL3MBTL1HTT
SCHEMBL8036790 0.94 KDM4E (0.39) KDM4EALDH1A1HPGDL3MBTL1HTT
SCHEMBL8036795 0.94 KDM4E (0.39) KDM4EALDH1A1HPGDL3MBTL1HTT
SCHEMBL8046458 0.94 KDM4E (0.39) KDM4EALDH1A1HPGDL3MBTL1HTT
SCHEMBL8047954 0.94 KDM4E (0.39) KDM4EALDH1A1HPGDL3MBTL1HTT
SCHEMBL8047958 0.94 KDM4E (0.39) KDM4EALDH1A1HPGDL3MBTL1HTT
SCHEMBL8054704 0.94 KDM4E (0.41) KDM4EALDH1A1HPGDL3MBTL1HTT

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-0643119-B1 Trans-olefin compounds, method for production thereof, liquid crystal composition containing the same as active ingredient, and liquid crystal element using said composition SUMITOMO CHEMICAL CO (JP) 2000-04-26 EP disclosed
US-5707547-A CONTAINING FLUORINATED BENZENE OR NAPHTHALENE RINGS AND/OR NITROGEN CONTAINING HETEROCYCLES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1998-01-13 US disclosed
EP-0643119-A1 Trans-olefin compounds, method for production thereof, liquid crystal composition containing the same as active ingredient, and liquid crystal element using said composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1995-03-15 EP disclosed