SCHEMBL15460898

SCHEMBL15460898

CCCC1CCC(C(F)(F)OC2CCC(c3ccc(C(F)(F)Oc4ccc(OC=C(F)F)cc4)c(F)c3)CC2)CC1

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.33
MAPK1 P28482 1/20 0.33
KMT2A Q03164 1/20 0.33
CYP2C9 P11712 1/20 0.32
ALDH1A1 P00352 1/20 0.31
LMNA P02545 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
SCHEMBL15460899 0.94
SCHEMBL15460910 0.92 MEN1 (0.32) MEN1MAPK1KMT2ACYP2C9ALDH1A1
SCHEMBL15461224 0.88 MEN1 (0.33) MEN1MAPK1KMT2ACYP2C9ALDH1A1
SCHEMBL15460900 0.86
SCHEMBL15460911 0.86
SCHEMBL15460718 0.83
SCHEMBL15461221 0.83 MEN1 (0.32) MEN1MAPK1KMT2ACYP2C9ALDH1A1
SCHEMBL15460892 0.82 CYP2C9 (0.35) MEN1MAPK1KMT2ACYP2C9ALDH1A1
SCHEMBL15460677 0.82 MEN1 (0.34) MEN1MAPK1KMT2ACYP2C9ALDH1A1
SCHEMBL15460935 0.81

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9273245-B2 Compound having 2,2-difluorovinyloxy group or 1,2,2-trifluorovinyloxy group, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2016-03-01 US disclosed
US-9273245-B2 Compound having 2,2-difluorovinyloxy group or 1,2,2-trifluorovinyloxy group, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2016-03-01 US disclosed
US-20140034876-A1 COMPOUND HAVING 2,2-DIFLUOROVINYLOXY GROUP OR 1,2,2-TRIFLUOROVINYLOXY GROUP, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC PETROCHEMICAL CORPORATION (JP) 2014-02-06 US disclosed
US-20140034876-A1 COMPOUND HAVING 2,2-DIFLUOROVINYLOXY GROUP OR 1,2,2-TRIFLUOROVINYLOXY GROUP, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC PETROCHEMICAL CORPORATION (JP) 2014-02-06 US disclosed