SCHEMBL14219987

SCHEMBL14219987

CCOc1c(F)cc(C2CCC(CCc3ccc(C[C@@H](C)c4ccccc4)cc3)CC2)cc1F

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 1/20 0.32
PDE5A O76074 1/20 0.32
KCNH2 Q12809 1/20 0.32
PTGDR2 Q9Y5Y4 2/20 0.31
PPARG P37231 1/20 0.31
PPARA Q07869 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
L3MBTL1 Q9Y468 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
SCHEMBL14219959 0.93 FFAR4 (0.36) SIGMAR1PTGDR2MEN1KMT2AL3MBTL1
SCHEMBL14219925 0.93 FFAR4 (0.36) SIGMAR1PTGDR2MEN1KMT2AL3MBTL1
SCHEMBL14219573 0.91 BACE1 (0.34)
SCHEMBL14220021 0.89 KDM1A (0.34) PDE5APTGDR2MEN1KMT2AL3MBTL1
SCHEMBL14219600 0.89 KDM1A (0.40) PTGDR2PPARGMEN1KMT2A
SCHEMBL14219984 0.89 KDM1A (0.40) PTGDR2PPARGMEN1KMT2A
SCHEMBL14219951 0.87 MEN1 (0.38) SIGMAR1KCNH2MEN1KMT2AL3MBTL1
SCHEMBL14219571 0.87 MAOB (0.32) SIGMAR1
SCHEMBL14219965 0.87 MAOB (0.32) SIGMAR1
SCHEMBL14219964 0.86 MAOB (0.34) SIGMAR1

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
EP-1650285-B1 Liquid crystal composition containing an optically active compound and liquid crystal electro-optical element SEIMI CHEM KK (JP) 2008-04-30 EP disclosed