SCHEMBL3911069

SCHEMBL3911069

CC(=O)NC1(c2ccc(F)c(F)c2)CCN(Cc2ccccc2)CC1

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TACR3 P29371 8/20 0.55
POLB P06746 3/20 0.53
DRD2 P14416 1/20 0.52
DRD4 P21917 1/20 0.52
DRD3 P35462 1/20 0.52
DPP4 P27487 1/20 0.51
CYP2C19 P33261 2/20 0.50
ALDH1A1 P00352 1/20 0.50
SIGMAR1 Q99720 2/20 0.48
CYP2D6 P10635 1/20 0.48
TACR2 P21452 2/20 0.47
TACR1 P25103 1/20 0.47
CCR3 P51677 1/20 0.46

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
SCHEMBL3897576 0.86 CYP2C19 (0.67) TACR3POLBDPP4CYP2C19ALDH1A1
SCHEMBL6499952 0.86 DRD2 (0.67) TACR3POLBDRD2DRD4DRD3
SCHEMBL4631243 0.85 POLB (0.64) TACR3POLBDRD2DRD4DRD3
Hydrochloric Acid SCHEMBL9317938 0.84 POLB (0.62) TACR3POLBDRD2DRD4DRD3
SCHEMBL3895807 0.84 DPP4 (0.52) TACR3POLBDPP4ALDH1A1SIGMAR1
SCHEMBL3907536 0.83 POLB (0.60) TACR3POLBDRD2DRD4DRD3
SCHEMBL4815864 0.82 OPRM1 (0.55) TACR3POLBDRD2DRD4DRD3
SCHEMBL27679274 0.81 POLB (0.58) TACR3POLBDRD2DRD4DRD3
SCHEMBL3895076 0.81 TACR3 (0.57) TACR3POLBDRD4CYP2C19ALDH1A1
SCHEMBL3905302 0.81 POLB (0.78) TACR3POLBDRD2DRD4DRD3

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 5 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 disclosed
US-7521449-B2 4-arylmorpholin-3-one derivatives, their preparation and therapeutic use thereof SANOFI-AVENTIS (FR) 2009-04-21 US disclosed
US-20070142349-A1 4-ARYLMORPHOLIN-3-ONE DERIVATIVES, THEIR PREPARATION AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2007-06-21 US 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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070142349-A1 4-ARYLMORPHOLIN-3-ONE DERIVATIVES, THEIR PREPARATION AND THERAPEUTIC USE THEREOF ADRB3, ADRA2C, OPRK1 TACR3 343/4885POLB 4026/4885DRD2 135/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.