SCHEMBL8997261

SCHEMBL8997261

CCCCCC1COC(c2ccc(F)c(F)c2)OC1

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.35
HTR2A P28223 1/20 0.34
HTR2C P28335 1/20 0.34
HTR2B P41595 1/20 0.34
IDO1 P14902 1/20 0.33
TDO2 P48775 1/20 0.33
CYP1A2 P05177 1/20 0.32
KDM1A O60341 1/20 0.32
GRM2 Q14416 3/20 0.32
DRD3 P35462 2/20 0.32
SLC10A2 Q12908 1/20 0.31
GCGR P47871 1/20 0.30
SLC6A2 P23975 1/20 0.30
SLC6A4 P31645 1/20 0.30
SLC6A3 Q01959 1/20 0.30
EPHX1 P07099 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
SCHEMBL9785318 1.00 ALDH1A1 (0.35) ALDH1A1HTR2AHTR2CHTR2BIDO1
SCHEMBL9785326 1.00 ALDH1A1 (0.35) ALDH1A1HTR2AHTR2CHTR2BIDO1
SCHEMBL9150714 0.99 ALDH1A1 (0.38) ALDH1A1HTR2AHTR2CHTR2BIDO1
SCHEMBL9151308 0.99 ALDH1A1 (0.38) ALDH1A1HTR2AHTR2CHTR2BIDO1
SCHEMBL9150002 0.99 ALDH1A1 (0.38) ALDH1A1HTR2AHTR2CHTR2BIDO1
SCHEMBL9150818 0.96 HTR2A (0.35) HTR2AHTR2CHTR2BIDO1TDO2
SCHEMBL9556245 0.95 MAPT (0.33) ALDH1A1HTR2AHTR2CHTR2BIDO1
SCHEMBL9556252 0.95 MAPT (0.33) ALDH1A1HTR2AHTR2CHTR2BIDO1
SCHEMBL9556141 0.94 GAA (0.34) ALDH1A1HTR2AHTR2CHTR2BCYP1A2
SCHEMBL10432609 0.94 GAA (0.34) ALDH1A1HTR2AHTR2CHTR2BCYP1A2

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5026879-A Liquid crystals having low threshold voltage, and wide visual angle; used in electro-optical displays SEIKO EPSON CORPORATION (JP) 1991-06-25 US claimed
JP-2196782-A None JP disclosed
EP-0471831-B1 LIQUID CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 1996-08-14 EP disclosed
US-5389289-A Chemical and heat resistance MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1995-02-14 US disclosed
EP-0395220-B1 1,3-dioxane derivative SEIKO EPSON CORP (JP) 1995-01-18 EP disclosed
US-5026879-A Liquid crystals having low threshold voltage, and wide visual angle; used in electro-optical displays SEIKO EPSON CORPORATION (JP) 1991-06-25 US disclosed
EP-0395220-A2 1,3-dioxane derivative SEIKO EPSON CORPORATION (JP) 1990-10-31 EP disclosed
JP-H02196782-A 1,3-DIOXAN DERIVATIVE SEIKO EPSON CORP 1990-08-03 JP disclosed