SCHEMBL6520810

SCHEMBL6520810

CCCC1CCC(C2CCC(C(CC(=O)O)c3ccc(OCC)c(F)c3F)CC2)CC1

nearest known ligand 0.37

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 18/20 0.37
PTGDR2 Q9Y5Y4 1/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.33

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
SCHEMBL17997300 0.82 PDE2A (0.36)
SCHEMBL6517547 0.81 F11 (0.38) ALDH1A1LMNAMAPT
SCHEMBL6517541 0.81 F11 (0.38) ALDH1A1LMNAMAPT
SCHEMBL8080646 0.80 KDM1A (0.30)
SCHEMBL25693810 0.78 PDE2A (0.39) ALDH1A1LMNAMAPT
SCHEMBL6520750 0.78 HPGD (0.45) ALDH1A1LMNAMAPT
SCHEMBL6520754 0.78 HPGD (0.45) ALDH1A1LMNAMAPT
SCHEMBL6517546 0.78 HPGD (0.45) ALDH1A1LMNAMAPT
SCHEMBL19167942 0.77 PDE2A (0.34)
SCHEMBL7046559 0.76 PPARG (0.33) FFAR1ALDH1A1LMNAMAPT

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-1179522-B1 Liquid crystalline compound having a difluoropropyleneoxy group as bonding group, liquid crystal composition and liquid crystal display element CHISSO CORP (JP) 2005-12-07 EP claimed