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SCHEMBL6667648

SCHEMBL6667648

CCC1CCC(c2ccc(C(F)(F)OC(C)c3ccc(OC(F)(F)F)cc3)cc2)CC1

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PDE2A O00408 5/20 0.36
▸ KDM1A O60341 1/20 0.36
▸ RCOR1 Q9UKL0 1/20 0.36
▸ EPHX2 P34913 4/20 0.34
▸ GPR139 Q6DWJ6 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ ACACB O00763 3/20 0.32
▸ HRH3 Q9Y5N1 1/20 0.32
▸ PTGS2 P35354 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
SCHEMBL6662713 0.92 ALDH1A1 (0.40) PDE2AKDM1ARCOR1EPHX2GPR139
SCHEMBL6666693 0.92 ALDH1A1 (0.36) ACACB
SCHEMBL6665370 0.90 PDE2A (0.34) PDE2AKDM1ARCOR1EPHX2GPR139
SCHEMBL6665032 0.89 PDE2A (0.34) PDE2AKDM1ARCOR1EPHX2GPR139
SCHEMBL6666568 0.89 PDE2A (0.33) PDE2AKDM1ARCOR1EPHX2GPR139
SCHEMBL6663970 0.89 PDE2A (0.33) PDE2AKDM1ARCOR1EPHX2GPR139
SCHEMBL6664067 0.89 PDE2A (0.33) PDE2AKDM1ARCOR1EPHX2GPR139
SCHEMBL6668743 0.89 PDE2A (0.33) PDE2AKDM1ARCOR1EPHX2GPR139
SCHEMBL6661289 0.89 PDE2A (0.33) PDE2AKDM1ARCOR1EPHX2GPR139
SCHEMBL6663330 0.87 ALDH1A1 (0.43) ACACB

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