SCHEMBL8036650

SCHEMBL8036650

CCCCCOC(C)CCC/C=C/c1ccc2cc(-c3ccc(O)c(F)c3)ccc2c1

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 5/20 0.38
ESR2 Q92731 5/20 0.38
MGLL Q99685 6/20 0.37
FAAH O00519 2/20 0.37
CNR1 P21554 2/20 0.37
APP P05067 4/20 0.36

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
SCHEMBL8036658 1.00 ESR1 (0.38) ESR1ESR2MGLLFAAHCNR1
SCHEMBL8054417 0.93 MGLL (0.39) MGLLFAAHCNR1APP
SCHEMBL8054415 0.93 MGLL (0.39) MGLLFAAHCNR1APP
SCHEMBL8036816 0.93 MGLL (0.39) MGLLFAAHCNR1APP
SCHEMBL8036820 0.93 MGLL (0.39) MGLLFAAHCNR1APP
SCHEMBL8048158 0.89 APP (0.32) ESR1ESR2MGLLFAAHCNR1
SCHEMBL8048165 0.89 APP (0.32) ESR1ESR2MGLLFAAHCNR1
SCHEMBL8051409 0.89 ABCG2 (0.38) ESR1ESR2CNR1APP
SCHEMBL8051404 0.89 ABCG2 (0.38) ESR1ESR2CNR1APP
SCHEMBL8047236 0.89 APP (0.34) APP

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 4 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-6030546-A FERROELECTRIC PHASE; LOW VISCOSITY;, THERMOSENSITIVITY OVER A BROAD AND EXHIBITS A LARGE TILT ANGLE AND A HIGH-SPEED RESPONSE PROPERTY;CHEMICAL INTERMEDIATES FOR PESTICIDES, DRUGS AND LIQUID CRYSTALS; BORIDING AND HYDROLYSIS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-02-29 US 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