SCHEMBL8945184

SCHEMBL8945184

CCCCCC1CCC(c2ccc(-c3ccc(-c4ccc(C)c(F)c4F)cc3)cc2F)CO1

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.32
ALDH1A1 P00352 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
SCHEMBL8945450 0.99 EPHX1 (0.33) EPHX1ALDH1A1
SCHEMBL18718362 0.93 DGAT1 (0.31)
SCHEMBL8944735 0.93 DGAT1 (0.31)
SCHEMBL8947069 0.91 EPHX1 (0.35) EPHX1ALDH1A1
SCHEMBL8944921 0.90 GRM2 (0.31) EPHX1
SCHEMBL15255946 0.90 DRD1 (0.33) EPHX1
SCHEMBL12999632 0.90 EPHX1 (0.33) EPHX1ALDH1A1
SCHEMBL8947165 0.90 EPHX1 (0.37) EPHX1ALDH1A1
SCHEMBL13262999 0.89 DRD1 (0.34) EPHX1ALDH1A1
SCHEMBL8945092 0.89 SLC6A2 (0.33)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2206695-B1 TETRA- OR PENTA-CYCLIC LIQUID CRYSTALLINE COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY ELEMENT JNC CORP (JP) 2013-09-18 EP disclosed
US-8187494-B2 Four- or five-ring liquid crystal compound having lateral fluorine, liquid crystal composition, and liquid crystal display device JNC CORPORATION (JP) 2012-05-29 US disclosed