SCHEMBL8037115

SCHEMBL8037115

C=CCc1ccc(-c2ccc(-c3ccc(/C=C/CCCC(C)O)cc3)c(F)c2F)cc1

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
KCNA3 P22001 2/20 0.33
TNNC1 P63316 1/20 0.32
ALOX5 P09917 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
SCHEMBL8037117 1.00 KCNA3 (0.33) KCNA3TNNC1ALOX5
SCHEMBL8054653 0.90 KCNA3 (0.34) KCNA3TNNC1ALOX5
SCHEMBL8048174 0.90 KCNA3 (0.34) KCNA3TNNC1ALOX5
SCHEMBL8048171 0.90 KCNA3 (0.34) KCNA3TNNC1ALOX5
SCHEMBL8054649 0.90 KCNA3 (0.34) KCNA3TNNC1ALOX5
SCHEMBL8049229 0.90 ALOX5 (0.33) ALOX5
SCHEMBL8049226 0.90 ALOX5 (0.33) ALOX5
SCHEMBL8049116 0.90 ALOX5 (0.35) KCNA3TNNC1ALOX5
SCHEMBL8036882 0.90
SCHEMBL8051328 0.90 KCNA3 (0.37) KCNA3ALOX5

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