SCHEMBL7177396

SCHEMBL7177396

C=CC1(c2ccc(F)c(F)c2)CN(C(=O)O)CCO1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TACR2 P21452 1/20 0.36
HCAR3 P49019 1/20 0.36
HCAR2 Q8TDS4 1/20 0.36
CNR1 P21554 5/20 0.33
NPC1 O15118 1/20 0.32
CCR2 P41597 1/20 0.32
KMT2A Q03164 2/20 0.32
MAPT P10636 1/20 0.32
TSHR P16473 1/20 0.32
MEN1 O00255 1/20 0.32
SLC6A2 P23975 2/20 0.31
SLC6A3 Q01959 2/20 0.31
DRD5 P21918 1/20 0.31
HTR2A P28223 1/20 0.31
HTR2C P28335 1/20 0.31
GPR183 P32249 1/20 0.31
OPRM1 P35372 1/20 0.31
OPRK1 P41145 1/20 0.31
HTR2B P41595 1/20 0.31
TMEM97 Q5BJF2 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
SCHEMBL4800637 0.82 MEN1 (0.47) NPC1KMT2AMEN1
Maleic Acid SCHEMBL4796837 0.77 MGLL (0.39) TACR2KMT2AHTR2AHTR2CHTR2B
Fumaric Acid SCHEMBL4796843 0.77 MGLL (0.39) TACR2KMT2AHTR2AHTR2CHTR2B
SCHEMBL7182943 0.75 RORC (0.38) KMT2A
SCHEMBL4799303 0.75 RORC (0.38) KMT2A
SCHEMBL4799313 0.75 RORC (0.38) KMT2A
SCHEMBL7186563 0.75 TACR2 (0.49) TACR2HCAR3HCAR2CNR1NPC1
Hydrochloric Acid SCHEMBL4802073 0.74 KDM4E (0.38) KMT2A
Hydrochloric Acid SCHEMBL4802092 0.74 KDM4E (0.38) KMT2A
SCHEMBL4800951 0.72 SLC6A3 (0.41) HCAR3HCAR2CCR2SLC6A2SLC6A3

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