SCHEMBL1384573

SCHEMBL1384573

CC(=O)NC1(c2ccccc2)CCN(CCC2(c3ccc(Cl)c(Cl)c3)CN(c3ccc(F)c(F)c3)C(=O)CO2)CC1

nearest known ligand 0.51

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TACR2 P21452 4/20 0.51
TACR1 P25103 3/20 0.48
TACR3 P29371 16/20 0.48

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
SCHEMBL1381405 0.93 TACR2 (0.50) TACR2TACR1TACR3
SCHEMBL1381258 0.93 TACR3 (0.52) TACR2TACR1TACR3
SCHEMBL1384598 0.93 TACR3 (0.51) TACR2TACR1TACR3
SCHEMBL1381888 0.92 TACR1 (0.52) TACR2TACR1TACR3
SCHEMBL1382624 0.90 TACR2 (0.45) TACR2TACR1TACR3
SCHEMBL1382630 0.90 TACR2 (0.57) TACR2TACR1TACR3
SCHEMBL1382015 0.88 TACR3 (0.50) TACR2TACR1TACR3
SCHEMBL1380221 0.88 TACR3 (0.51) TACR2TACR1TACR3
Hydrochloric Acid SCHEMBL3906709 0.88 TACR3 (0.49) TACR2TACR1TACR3
SCHEMBL3898510 0.87 TACR3 (0.53) TACR2TACR1TACR3

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1773823-B1 4-ARYLMORPHOLIN-3-ONE DERIVATIVES, PREPARATION AND THERAPEUTIC USE THEREOF SANOFI SA (FR) 2013-08-21 EP claimed
JP-4812759-B2 2011-11-09 JP claimed
EP-1773823-A1 4-ARYLMORPHOLIN-3-ONE DERIVATIVES, PREPARATION AND THERAPEUTIC USE THEREOF Sanofi-Aventis (FR) 2007-04-18 EP claimed
WO-2006021654-A1 4-ARYLMORPHOLIN-3-ONE DERIVATIVES, PREPARATION AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2006-03-02 WO claimed
EP-1773823-B1 4-ARYLMORPHOLIN-3-ONE DERIVATIVES, PREPARATION AND THERAPEUTIC USE THEREOF SANOFI SA (FR) 2013-08-21 EP disclosed
EP-1773823-A1 4-ARYLMORPHOLIN-3-ONE DERIVATIVES, PREPARATION AND THERAPEUTIC USE THEREOF Sanofi-Aventis (FR) 2007-04-18 EP disclosed
WO-2006021654-A1 4-ARYLMORPHOLIN-3-ONE DERIVATIVES, PREPARATION AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2006-03-02 WO disclosed