SCHEMBL8054166

SCHEMBL8054166

C=CCc1ccc2cc(C=CCCCC(C)OCCCCC)ccc2c1

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 2/20 0.36
TRPM8 Q7Z2W7 3/20 0.35
TNNC1 P63316 1/20 0.34
BDKRB2 P30411 1/20 0.34
CNR1 P21554 1/20 0.34
MAPT P10636 1/20 0.32
ALDH1A1 P00352 2/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
KDM4E B2RXH2 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
SCHEMBL8054164 1.00 CNR2 (0.36) CNR2TRPM8TNNC1BDKRB2CNR1
SCHEMBL8046699 0.92 CNR2 (0.36) CNR2TRPM8TNNC1CNR1
SCHEMBL8046702 0.92 CNR2 (0.36) CNR2TRPM8TNNC1CNR1
SCHEMBL8051449 0.92 CNR2 (0.38) CNR2TRPM8TNNC1BDKRB2CNR1
SCHEMBL8051446 0.92 CNR2 (0.38) CNR2TRPM8TNNC1BDKRB2CNR1
SCHEMBL8047729 0.89 CNR2 (0.39) CNR2TRPM8CNR1
SCHEMBL8047720 0.89 CNR2 (0.39) CNR2TRPM8CNR1
SCHEMBL8036480 0.89 CNR2 (0.39) CNR2TRPM8CNR1
SCHEMBL8036475 0.89 CNR2 (0.39) CNR2TRPM8CNR1
SCHEMBL8047999 0.88 CNR2 (0.36) CNR2TRPM8BDKRB2CNR1MAPT

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