SCHEMBL8049586

SCHEMBL8049586

CC(O)CCCC=Cc1ccc(-c2ccc(O)cc2F)cn1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 7/20 0.38
ESR2 Q92731 2/20 0.38
USP7 Q93009 1/20 0.38
FGFR1 P11362 1/20 0.37
FGFR2 P21802 1/20 0.37
CYP3A4 P08684 2/20 0.35
CYP2C19 P33261 2/20 0.35
ALOX5AP P20292 5/20 0.35
FEN1 P39748 5/20 0.35
TYR P14679 2/20 0.35
APP P05067 1/20 0.34
CYP2C9 P11712 1/20 0.34
HSD17B1 P14061 1/20 0.33
HSD17B2 P37059 1/20 0.33
JAK1 P23458 1/20 0.32

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
SCHEMBL8049581 1.00 ESR1 (0.38) ESR1ESR2USP7FGFR1FGFR2
SCHEMBL8035327 0.97 CYP3A4 (0.37) ESR1ESR2USP7FGFR1FGFR2
SCHEMBL8035324 0.97 CYP3A4 (0.37) ESR1ESR2USP7FGFR1FGFR2
SCHEMBL8052361 0.89 ALOX5AP (0.36) ESR1ESR2USP7FGFR1FGFR2
SCHEMBL8052366 0.89 ALOX5AP (0.36) ESR1ESR2USP7FGFR1FGFR2
SCHEMBL8044668 0.88 APP (0.37) ESR1ESR2USP7FGFR1FGFR2
SCHEMBL8044671 0.88 APP (0.37) ESR1ESR2USP7FGFR1FGFR2
SCHEMBL8052930 0.87 USP7 (0.35) ESR1ESR2USP7FGFR1FGFR2
SCHEMBL8046061 0.87 USP7 (0.35) ESR1ESR2USP7FGFR1FGFR2
SCHEMBL8046064 0.87 USP7 (0.35) ESR1ESR2USP7FGFR1FGFR2

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