SCHEMBL8048788

SCHEMBL8048788

C=CCc1ccc(-c2ccc3nc(/C=C/CCCC(C)O)ncc3c2)cc1

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 1/20 0.35
PDE3A Q14432 1/20 0.35
P2RY12 Q9H244 1/20 0.35
PTGS2 P35354 1/20 0.32
ALOX5 P09917 1/20 0.30
FGFR4 P22455 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
SCHEMBL8048793 1.00 PDE3B (0.35) PDE3BPDE3AP2RY12PTGS2ALOX5
SCHEMBL8049156 0.92 PDE3B (0.35) PDE3BPDE3AP2RY12ALOX5
SCHEMBL8049151 0.92 PDE3B (0.35) PDE3BPDE3AP2RY12ALOX5
SCHEMBL8045936 0.88 ALOX5 (0.33) PDE3BPDE3AP2RY12ALOX5
SCHEMBL8045940 0.88 ALOX5 (0.33) PDE3BPDE3AP2RY12ALOX5
SCHEMBL8036308 0.87 PDE3B (0.33) PDE3BPDE3AP2RY12
SCHEMBL8036314 0.87 PDE3B (0.33) PDE3BPDE3AP2RY12
SCHEMBL8049882 0.86 PDE3B (0.38) PDE3BPDE3AP2RY12
SCHEMBL8049887 0.86 PDE3B (0.38) PDE3BPDE3AP2RY12
SCHEMBL8036948 0.86 PDE3B (0.40) PDE3BPDE3AP2RY12FGFR4

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