SCHEMBL7182943

SCHEMBL7182943

C=C[C@@]1(c2ccc(F)c(F)c2)CN(Cc2ccccc2)CCO1

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
RORC P51449 5/20 0.38
DRD4 P21917 1/20 0.38
MGLL Q99685 2/20 0.37
KDM4E B2RXH2 1/20 0.37
KMT2A Q03164 1/20 0.37
SIGMAR1 Q99720 3/20 0.36
POLB P06746 1/20 0.36
CCR3 P51677 1/20 0.36
ALDH1A1 P00352 1/20 0.35
HTT P42858 1/20 0.35

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
SCHEMBL4799303 1.00 RORC (0.38) RORCDRD4MGLLKDM4EKMT2A
SCHEMBL4799313 1.00 RORC (0.38) RORCDRD4MGLLKDM4EKMT2A
Hydrochloric Acid SCHEMBL4802092 0.99 KDM4E (0.38) RORCDRD4MGLLKDM4EKMT2A
Hydrochloric Acid SCHEMBL4802073 0.99 KDM4E (0.38) RORCDRD4MGLLKDM4EKMT2A
Fumaric Acid SCHEMBL4796843 0.93 MGLL (0.39) RORCMGLLKDM4EKMT2ASIGMAR1
Maleic Acid SCHEMBL4796837 0.93 MGLL (0.39) RORCMGLLKDM4EKMT2ASIGMAR1
SCHEMBL14180280 0.84 DRD4 (0.38) RORCDRD4MGLLKDM4EKMT2A
SCHEMBL4800637 0.77 MEN1 (0.47) RORCKMT2A
SCHEMBL7180636 0.76 TACR2 (0.43) RORCDRD4MGLLKDM4EKMT2A
SCHEMBL7174179 0.76 TACR2 (0.43) RORCDRD4MGLLKDM4EKMT2A

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