SCHEMBL7186563

SCHEMBL7186563

O=C(O)N1CCOC(CCO)(c2ccc(F)c(F)c2)C1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TACR2 P21452 1/20 0.49
HSD11B1 P28845 8/20 0.33
CYP2C9 P11712 3/20 0.33
CYP3A4 P08684 2/20 0.33
CYP2C19 P33261 2/20 0.33
HSD3B2 P26439 1/20 0.33
HCAR3 P49019 1/20 0.33
HCAR2 Q8TDS4 1/20 0.33
CNR1 P21554 2/20 0.32
KIF11 P52732 2/20 0.32
NPC1 O15118 1/20 0.32
CCR2 P41597 1/20 0.32
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
TSHR P16473 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 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
SCHEMBL4631267 0.88 TACR2 (0.62) TACR2CYP3A4CNR1TSHR
SCHEMBL4800783 0.83 MEN1 (0.47) TACR2CYP2C19NPC1MEN1KMT2A
SCHEMBL4631280 0.82 TACR2 (0.49) TACR2CYP2C9CYP3A4CYP2C19TSHR
SCHEMBL7174179 0.78 TACR2 (0.43) TACR2KMT2A
SCHEMBL7180636 0.78 TACR2 (0.43) TACR2KMT2A
SCHEMBL27394574 0.78 TACR2 (0.42) TACR2HSD11B1CYP2C9CYP3A4CYP2C19
Hydrochloric Acid SCHEMBL4802792 0.77 TACR2 (0.42) TACR2KMT2A
Hydrochloric Acid SCHEMBL4800620 0.77 TACR2 (0.42) TACR2KMT2A
SCHEMBL4630858 0.76 TACR2 (0.43) TACR2
SCHEMBL2294993 0.75 HSD11B1 (0.39) TACR2HSD11B1CNR1NPC1LMNA

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-1200417-B1 METHOD FOR PREPARING 2-(2-ARYLMORPHOLIN-2-YL)ETHANOL DERIVATIVES AND INTERMEDIATES SANOFI SYNTHELABO (FR) 2003-10-22 EP disclosed
EP-1200417-A1 METHOD FOR PREPARING 2-(2-ARYLMORPHOLIN-2-YL)ETHANOL DERIVATIVES AND INTERMEDIATES SANOFI-SYNTHELABO (FR) 2002-05-02 EP disclosed
WO-2001004105-A1 METHOD FOR PREPARING 2-(2-ARYLMORPHOLIN-2-YL)ETHANOL DERIVATIVES AND INTERMEDIATES SANOFI-SYNTHELABO (FR) 2001-01-18 WO disclosed