SCHEMBL8036458

SCHEMBL8036458

CCCCCOC(C)CCCC=Cc1ccc(-c2ccc(O)nc2)c(F)c1

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 7/20 0.35
FEN1 P39748 7/20 0.35
RARB P10826 1/20 0.34
MAOB P27338 4/20 0.33
ALDH1A1 P00352 1/20 0.32
CNR1 P21554 1/20 0.32
CNR2 P34972 1/20 0.32
APP P05067 1/20 0.31
FAAH O00519 1/20 0.31
PTGS2 P35354 1/20 0.31

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
SCHEMBL8036453 1.00 ALOX5AP (0.35) ALOX5APFEN1RARBMAOBALDH1A1
SCHEMBL8053848 0.97 ALOX5AP (0.35) ALOX5APFEN1RARBMAOBALDH1A1
SCHEMBL8053840 0.97 ALOX5AP (0.35) ALOX5APFEN1RARBMAOBALDH1A1
SCHEMBL8046695 0.91 ALOX5AP (0.36) ALOX5APFEN1RARBMAOBALDH1A1
SCHEMBL8046690 0.91 ALOX5AP (0.36) ALOX5APFEN1RARBMAOBALDH1A1
SCHEMBL8051069 0.91 ALOX5AP (0.36) ALOX5APFEN1RARBMAOBALDH1A1
SCHEMBL8051074 0.91 ALOX5AP (0.36) ALOX5APFEN1RARBMAOBALDH1A1
SCHEMBL8047607 0.89 NPC1 (0.39) ALOX5APFEN1RARBMAOBALDH1A1
SCHEMBL8047613 0.89 NPC1 (0.39) ALOX5APFEN1RARBMAOBALDH1A1
SCHEMBL8049222 0.89 FEN1 (0.35) ALOX5APFEN1RARBMAOB

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