SCHEMBL15316618

SCHEMBL15316618

CCCCCC1CCC(C2C=CC(c3ccc(C4CCC(CCC)CC4)c(F)c3F)CC2)CC1

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.32
GAA P10253 1/20 0.32
MEN1 O00255 3/20 0.31
KMT2A Q03164 3/20 0.31
CYP2C9 P11712 1/20 0.31
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
MAPK1 P28482 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
SCHEMBL15316626 0.94 GAA (0.32) MAPTGAAMEN1KMT2A
SCHEMBL15220919 0.91
SCHEMBL15316617 0.90
SCHEMBL15220885 0.87 MAPT (0.33) MAPTGAAMEN1KMT2A
SCHEMBL15219894 0.87 CYP2C9 (0.32) MAPTGAAMEN1KMT2ACYP2C9
SCHEMBL15316518 0.87
SCHEMBL15220833 0.86 CYP2C9 (0.31) MAPTGAAMEN1KMT2ACYP2C9
SCHEMBL15220836 0.86 GAA (0.32) MAPTGAAMEN1KMT2A
SCHEMBL15316634 0.86 OPRL1 (0.35) MAPTGAAMEN1KMT2A
SCHEMBL15220921 0.86

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9090825-B2 Cyclohexene-3,6-diyl compound, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2015-07-28 US disclosed
US-8956552-B2 Cyclohexene-3,6-diyl compound, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2015-02-17 US disclosed
US-20130270480-A1 CYCLOHEXENE-3,6-DIYL COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC PETROCHEMICAL CORPORATION 2013-10-17 US disclosed