SCHEMBL8048987

SCHEMBL8048987

C=CCc1cnc2cc(C=CCCCC(C)O)ccc2n1

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 1/20 0.31
PDE3A Q14432 1/20 0.31
P2RY12 Q9H244 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
SCHEMBL8048983 1.00 PDE3B (0.31) PDE3BPDE3AP2RY12
SCHEMBL8046209 0.92 LIPG (0.33) PDE3BPDE3AP2RY12
SCHEMBL8046215 0.92 LIPG (0.33) PDE3BPDE3AP2RY12
SCHEMBL8602653 0.89
SCHEMBL8602655 0.89
SCHEMBL8051783 0.89 ALOX5AP (0.31)
SCHEMBL8051788 0.89 ALOX5AP (0.31)
SCHEMBL8049012 0.84 HDAC1 (0.32) PDE3BPDE3AP2RY12
SCHEMBL8049010 0.84 HDAC1 (0.32) PDE3BPDE3AP2RY12
SCHEMBL8051343 0.84 PDE3B (0.30) PDE3BPDE3AP2RY12

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 3 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-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