SCHEMBL6662000

SCHEMBL6662000

CCCc1ccc(C(F)(F)OC(C)c2ccc(OC(F)F)c(F)c2)cc1

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 8/20 0.35
CACNA1H O95180 2/20 0.34
PDE4A P27815 5/20 0.32
CASR P41180 1/20 0.32
GPR139 Q6DWJ6 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
SCHEMBL6661857 0.92 PDE2A (0.34) PDE2ACACNA1HPDE4ACASR
SCHEMBL6661305 0.91 PDE4A (0.38) PDE2ACACNA1HPDE4ACASR
SCHEMBL6666741 0.87 PDE2A (0.43) PDE2ACACNA1HCASR
SCHEMBL6664038 0.86
SCHEMBL6665133 0.86 ALDH1A1 (0.34) PDE2ACASR
SCHEMBL6662181 0.83 KMT2A (0.33) CASR
SCHEMBL6667147 0.82 FFAR1 (0.37) PDE2A
SCHEMBL6663310 0.82 DAO (0.37)
SCHEMBL6661128 0.81 KMT2A (0.36) PDE2A
SCHEMBL7732920 0.81 FFAR1 (0.36) PDE2ACACNA1H

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-0893423-B1 LIQUID CRYSTAL COMPOUNDS HAVING FLUORINATED LINKAGES, LIQUID CRYSTAL COMPOSITIONS, AND LIQUID CRYSTAL DISPLAY DEVICES CHISSO CORP (JP) 2004-09-01 EP disclosed