SCHEMBL20004705

SCHEMBL20004705

Cc1ccc(-c2ccc(-c3cc(C)c(C#Cc4ccc(-c5cc(F)c6c(F)c(F)c(F)cc6c5)c(F)c4)c(F)c3)c(F)c2)cc1

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 1/20 0.32
PDE3B Q13370 1/20 0.30
PDE3A Q14432 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
SCHEMBL20004826 0.95 PDE3B (0.31) PDE3BPDE3A
SCHEMBL20004931 0.94 PDE3B (0.30) PDE3BPDE3A
SCHEMBL20005269 0.94 GRM5 (0.33) GRM5
SCHEMBL19999600 0.86 RARB (0.35)
SCHEMBL20005223 0.86 GRM5 (0.34) GRM5PDE3BPDE3A
SCHEMBL20004910 0.85 GRM5 (0.33) GRM5PDE3BPDE3A
SCHEMBL20005288 0.84 PDE3B (0.32) PDE3BPDE3A
SCHEMBL19999476 0.84 GRM5 (0.30) GRM5
SCHEMBL19999632 0.83
SCHEMBL19999400 0.83

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3299439-A1 LIQUID CRYSTAL COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC Corporation (JP) 2018-03-28 EP disclosed