SCHEMBL8050779

SCHEMBL8050779

C=CCOc1ccc2cc(-c3ccc(/C=C/CCCC(C)OCCCCC)c(F)c3)ccc2c1

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SRC P12931 4/20 0.36
ABL1 P00519 2/20 0.36
CA12 O43570 3/20 0.33
CA1 P00915 3/20 0.33
CA9 Q16790 3/20 0.33
CASR P41180 1/20 0.31
RARA P10276 1/20 0.30
RARB P10826 1/20 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
SCHEMBL8050781 1.00 SRC (0.36) SRCABL1CA12CA1CA9
SCHEMBL8046612 0.95 RARB (0.35) SRCABL1RARARARB
SCHEMBL8036742 0.95 RARB (0.35) SRCABL1RARARARB
SCHEMBL8046615 0.95 RARB (0.35) SRCABL1RARARARB
SCHEMBL8036745 0.95 RARB (0.35) SRCABL1RARARARB
SCHEMBL8051701 0.92 MAPT (0.36) SRCABL1CA12CA1CA9
SCHEMBL8051699 0.92 MAPT (0.36) SRCABL1CA12CA1CA9
SCHEMBL8054109 0.91 SRC (0.33) SRCABL1CASR
SCHEMBL8054104 0.91 SRC (0.33) SRCABL1CASR
SCHEMBL8049099 0.90 SRC (0.35) SRCABL1CA12CA1CA9

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