SCHEMBL6754087

SCHEMBL6754087

Fc1cc(C(CC2CCCCC2)C2CCCCC2)cc(F)c1N(Cc1ccccc1)Cc1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.39
G6PC1 P35575 1/20 0.36
AGER Q15109 2/20 0.34
MTNR1A P48039 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
PSEN1 P49768 1/20 0.34
PSEN2 P49810 1/20 0.34
APH1B Q8WW43 1/20 0.34
NCSTN Q92542 1/20 0.34
APH1A Q96BI3 1/20 0.34
PSENEN Q9NZ42 1/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
PKM P14618 1/20 0.34
CTDSP1 Q9GZU7 1/20 0.34
LMNA P02545 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
DPP4 P27487 1/20 0.33
DPP8 Q6V1X1 1/20 0.33
DPP9 Q86TI2 1/20 0.33

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
SCHEMBL10453959 0.75 MEN1 (0.53) L3MBTL1MEN1KMT2APKMCTDSP1
SCHEMBL3966889 0.75 MEN1 (0.53) L3MBTL1MEN1KMT2APKMCTDSP1
SCHEMBL8042705 0.74 SLC6A3 (0.43) MEN1KMT2APKMCTDSP1SMN1; SMN2
SCHEMBL6756588 0.74 DPP4 (0.42) MEN1KMT2ADPP4
SCHEMBL8046455 0.68 SLC6A3 (0.38) DPP4
SCHEMBL11715973 0.67 FFAR1 (0.44) L3MBTL1MEN1KMT2APKMCTDSP1
SCHEMBL2467478 0.66 MEN1 (0.53) L3MBTL1MEN1KMT2APKMCTDSP1
SCHEMBL6756372 0.66 GBA1 (0.43) SMN1; SMN2
SCHEMBL2886678 0.66 TSHR (0.40) SMN1; SMN2
SCHEMBL29097501 0.66 SLC6A3 (0.40) MEN1KMT2APKMCTDSP1DPP4

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
US-6716491-B2 BASED ON MIXTURE OF POLAR COMPOUNDS OF POSITIVE DIELECTRIC ANISOTROPY; FOR USE IN MATRIX LIQUID CRYSTAL AND TWISTED/SUPERTWISTED NEMATIC CELLS MERCK PATENT GMBH (DE) 2004-04-06 US disclosed
US-20020030180-A1 Liquid-crystalline medium MERCK PATENT GMBH (DE) 2002-03-14 US disclosed