SCHEMBL8047712

SCHEMBL8047712

C=CCc1ccc(-c2ncc(-c3ccc(C=CCCCC(C)O)cc3F)cn2)cc1

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
FEN1 P39748 12/20 0.34
ALOX5AP P20292 11/20 0.34
KCNA3 P22001 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
SCHEMBL8047708 1.00 FEN1 (0.34) FEN1ALOX5APKCNA3
SCHEMBL8047686 0.94 ALOX5AP (0.33) FEN1ALOX5AP
SCHEMBL8047692 0.94 ALOX5AP (0.33) FEN1ALOX5AP
SCHEMBL8046239 0.94 ALOX5AP (0.32) FEN1ALOX5APKCNA3
SCHEMBL8046243 0.94 ALOX5AP (0.32) FEN1ALOX5APKCNA3
SCHEMBL8047402 0.93 ALOX5AP (0.32) FEN1ALOX5APKCNA3
SCHEMBL8047407 0.93 ALOX5AP (0.32) FEN1ALOX5APKCNA3
SCHEMBL8047849 0.91 KDM4E (0.34) FEN1ALOX5APKCNA3
SCHEMBL8047852 0.91 KDM4E (0.34) FEN1ALOX5APKCNA3
SCHEMBL8046549 0.90 CNR2 (0.32) FEN1ALOX5AP

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