SCHEMBL22277172

SCHEMBL22277172

CCCCCC1CCC(COC2CCC(C3CCC(c4ccc(OCC)c(F)c4F)CC3)CC2)CC1

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 6/20 0.35
HCRTR2 O43614 4/20 0.32
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.31

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
SCHEMBL22277365 1.00 GPR119 (0.35) GPR119HCRTR2GAAMAPT
SCHEMBL22277350 0.92 GPR119 (0.36) GPR119HCRTR2MAPT
SCHEMBL22277503 0.92 GPR119 (0.36) GPR119HCRTR2MAPT
SCHEMBL22277535 0.92 GPR119 (0.36) GPR119HCRTR2MAPT
SCHEMBL8452717 0.92 MAPT (0.34) GAAMAPT
SCHEMBL15203896 0.92 MAPT (0.34) GAAMAPT
SCHEMBL423545 0.92 MAPT (0.34) GAAMAPT
SCHEMBL22277339 0.92 MAPT (0.34) GAAMAPT
SCHEMBL10091129 0.92 MAPT (0.34) GAAMAPT
SCHEMBL3437333 0.92 MAPT (0.34) GAAMAPT

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
US-20200239775-A1 TETRACYCLIC LIQUID CRYSTAL COMPOUND HAVING DIATOMIC BONDING GROUP AND 2,3-DIFLUOROPHENYLENE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORPORATION (JP) 2020-07-30 US disclosed