SCHEMBL6664066

SCHEMBL6664066

C=CCCC1CCC(c2ccc(C(C)OC(F)(F)c3ccc(C4CCC(C=C)CC4)cc3)cc2)CC1

nearest known ligand 0.31

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ACACB O00763 1/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
ESR2 Q92731 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
SCHEMBL6662956 1.00 ACACB (0.31) ACACBALDH1A1LMNAMAPTESR2
SCHEMBL6665868 0.96 ACACB (0.33) ACACBALDH1A1LMNAMAPTESR2
SCHEMBL6667704 0.93 HTR2C (0.36) ACACBALDH1A1LMNAMAPTESR2
SCHEMBL6664905 0.92
SCHEMBL6663973 0.92
SCHEMBL6665991 0.92
SCHEMBL6664183 0.92
SCHEMBL6665432 0.92 ALDH1A1 (0.33) ACACBALDH1A1LMNAMAPTESR2
SCHEMBL6663061 0.92 ALDH1A1 (0.40) ACACBALDH1A1LMNAMAPTESR2
SCHEMBL6665115 0.92 ALDH1A1 (0.40) ACACBALDH1A1LMNAMAPTESR2

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