SCHEMBL14765895

SCHEMBL14765895

CCCCOc1ccc(C2CCC(CCc3ccc(C4CCC(OCCCC)CC4)c(F)c3F)CC2)cc1F

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 2/20 0.34
SCN9A Q15858 1/20 0.33
PDE4A P27815 1/20 0.32
PDE4B Q07343 1/20 0.32
PDE4C Q08493 1/20 0.32
PDE4D Q08499 1/20 0.32
HPGD P15428 1/20 0.31
PPARG P37231 4/20 0.31
PPARD Q03181 1/20 0.31
PPARA Q07869 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
SCHEMBL14765766 0.97 KDM1A (0.38) KDM1ASCN9A
SCHEMBL14766312 0.97 KDM1A (0.33) KDM1ASCN9APDE4APDE4BPDE4C
SCHEMBL14765767 0.94 KDM1A (0.31) KDM1A
SCHEMBL14765768 0.93 SCN9A (0.31) KDM1ASCN9A
SCHEMBL12734959 0.91 SCN9A (0.33) KDM1ASCN9APDE4APDE4BPDE4C
SCHEMBL14765929 0.91 KDM1A (0.41) KDM1AHPGD
SCHEMBL14765892 0.91 SCN9A (0.32) SCN9APPARGPPARDPPARA
SCHEMBL14766647 0.91 SCN9A (0.32) SCN9APPARGPPARDPPARA
SCHEMBL14765674 0.89 KDM1A (0.41) KDM1ASCN9APDE4APDE4BPDE4C
SCHEMBL14766128 0.89 KDM1A (0.36) KDM1ASCN9APDE4APDE4BPDE4C

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-8394294-B2 Four-ring liquid crystal compound having lateral fluorine, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2013-03-12 US disclosed