SCHEMBL2363906

SCHEMBL2363906

Nc1cc(N2CCOCC2)c(F)cc1Nc1cc(F)c(N2CCOCC2)cc1N

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.46
LGMN Q99538 2/20 0.45
LMNA P02545 3/20 0.44
KDM4E B2RXH2 2/20 0.44
MAPT P10636 6/20 0.43
CYP1A2 P05177 2/20 0.43
CYP3A4 P08684 2/20 0.43
CYP2C19 P33261 2/20 0.43
CYP2D6 P10635 1/20 0.43
CYP2C9 P11712 1/20 0.43
GAA P10253 4/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
HPGD P15428 4/20 0.40
CASP1 P29466 1/20 0.40
MAPK1 P28482 2/20 0.40
NPC1 O15118 2/20 0.40
TP53 P04637 1/20 0.40
ALOX15 P16050 1/20 0.40
TSHR P16473 1/20 0.40
RAB9A P51151 1/20 0.40

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
SCHEMBL29744988 0.84 LGMN (0.51) ALDH1A1LGMNLMNAKDM4EMAPT
SCHEMBL2311204 0.84 LGMN (0.51) ALDH1A1LGMNLMNAKDM4EMAPT
SCHEMBL24196340 0.83 ALDH1A1 (0.50) ALDH1A1LGMNLMNAKDM4EMAPT
SCHEMBL518889 0.80 ALDH1A1 (0.50) ALDH1A1LGMNLMNAKDM4EMAPT
SCHEMBL21262291 0.79 MAPT (0.54) ALDH1A1LGMNLMNAKDM4EMAPT
SCHEMBL3922530 0.79 ALDH1A1 (0.50) ALDH1A1LGMNLMNAKDM4EMAPT
SCHEMBL10994974 0.79 ALDH1A1 (0.47) ALDH1A1LGMNLMNAKDM4EMAPT
SCHEMBL2314955 0.78 ALDH1A1 (0.57) ALDH1A1LGMNLMNAKDM4EMAPT
SCHEMBL29300840 0.75 ALDH1A1 (0.47) ALDH1A1LGMNLMNAKDM4EMAPT
SCHEMBL23759790 0.75 ALDH1A1 (0.61) ALDH1A1LGMNLMNAKDM4EMAPT

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
EP-1888579-B1 NOVEL FLUORENE DERIVATIVES, COMPOSITION CONTAINING SAID DERIVATIVES AND THE USE THEREOF AVENTIS PHARMA SA (FR) 2011-08-03 EP disclosed
EP-1888579-A2 NOVEL FLUORENE DERIVATIVES, COMPOSITION CONTAINING SAID DERIVATIVES AND THE USE THEREOF Aventis Pharma S.A. (FR) 2008-02-20 EP disclosed
WO-2006123061-A2 FLUORENE DERIVATIVES, COMPOSITION CONTAINING SAID DERIVATIVES AND THE USE THEREOF AVENTIS PHARMA S.A. (FR) 2006-11-23 WO disclosed