SCHEMBL8053963

SCHEMBL8053963

C=CCc1ccc2cc(-c3ccc(C=CCCCC(C)OCCCCC)c(F)c3F)ccc2c1

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 3/20 0.38
CNR1 P21554 1/20 0.36
GABRA1 P14867 7/20 0.33
GABRB2 P47870 7/20 0.33
ALOX5 P09917 4/20 0.31
TRPM8 Q7Z2W7 3/20 0.30

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
SCHEMBL8053957 1.00 CNR2 (0.38) CNR2CNR1GABRA1GABRB2ALOX5
SCHEMBL8051219 0.91 CNR2 (0.35) CNR2CNR1GABRA1GABRB2TRPM8
SCHEMBL8051226 0.91 CNR2 (0.35) CNR2CNR1GABRA1GABRB2TRPM8
SCHEMBL8051705 0.90 CNR2 (0.35) CNR2CNR1TRPM8
SCHEMBL8051706 0.90 CNR2 (0.35) CNR2CNR1TRPM8
SCHEMBL8048464 0.90 CNR2 (0.32) CNR2CNR1TRPM8
SCHEMBL8048460 0.90 CNR2 (0.32) CNR2CNR1TRPM8
SCHEMBL8049099 0.89 SRC (0.35) CNR2
SCHEMBL8049095 0.89 SRC (0.35) CNR2
SCHEMBL8051348 0.89 CNR2 (0.36) CNR2CNR1GABRA1GABRB2TRPM8

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