SCHEMBL3908960

SCHEMBL3908960

Cc1ccc(C2(C#N)CCN(Cc3ccccc3)CC2)cc1C

nearest known ligand 0.71

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 3/20 0.71
OPRL1 P41146 4/20 0.59
OPRD1 P41143 1/20 0.48
CHRM4 P08173 1/20 0.47
CCR3 P51677 1/20 0.45
DRD2 P14416 1/20 0.45
DRD4 P21917 1/20 0.45
DRD3 P35462 1/20 0.45
POLB P06746 1/20 0.45

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
SCHEMBL8040811 0.89 OPRM1 (0.66) OPRM1OPRL1OPRD1CHRM4CCR3
SCHEMBL5193076 0.87 OPRM1 (0.52) OPRM1OPRL1CCR3DRD2POLB
SCHEMBL8350406 0.85 OPRM1 (0.81) OPRM1OPRL1OPRD1CHRM4DRD2
SCHEMBL476404 0.83 OPRM1 (1.00) OPRM1OPRL1OPRD1CHRM4DRD2
SCHEMBL13543973 0.83 OPRL1 (0.79) OPRM1OPRL1OPRD1CHRM4CCR3
Hydrochloric Acid SCHEMBL2473959 0.82 OPRM1 (0.97) OPRM1OPRL1OPRD1CHRM4DRD2
SCHEMBL31567223 0.82 OPRM1 (0.71) OPRM1OPRL1OPRD1CHRM4CCR3
SCHEMBL3895012 0.81 OPRM1 (0.83) OPRM1OPRL1OPRD1CHRM4CCR3
SCHEMBL6248119 0.80 OPRM1 (0.68) OPRM1OPRL1
SCHEMBL373586 0.80 OPRM1 (0.81) OPRM1OPRL1OPRD1CHRM4DRD2

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 OPRM1 5/4885OPRL1 9/4885OPRD1 12/4885

“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.