SCHEMBL6906596

SCHEMBL6906596

CC(F)(F)c1cccc(N=C2C(=O)N(c3ccsc3)c3ccccc32)c1

nearest known ligand 0.64

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GALR3 O60755 20/20 0.64
HTR4 Q13639 1/20 0.64
DRD5 P21918 2/20 0.50
ADRA1A P35348 1/20 0.49

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
SCHEMBL917003 0.92 GALR3 (0.76) GALR3HTR4DRD5ADRA1A
SCHEMBL917001 0.92 GALR3 (0.76) GALR3HTR4DRD5ADRA1A
SCHEMBL8164607 0.87 GALR3 (0.83) GALR3HTR4DRD5ADRA1A
SCHEMBL6904884 0.87 GALR3 (0.83) GALR3HTR4DRD5ADRA1A
SCHEMBL917766 0.86 GALR3 (0.55) GALR3HTR4DRD5ADRA1A
SCHEMBL917768 0.86 GALR3 (0.55) GALR3HTR4DRD5ADRA1A
SCHEMBL916633 0.84 GALR3 (0.52) GALR3HTR4DRD5ADRA1A
SCHEMBL916632 0.84 GALR3 (0.52) GALR3HTR4DRD5ADRA1A
SCHEMBL8171376 0.83 GALR3 (0.69) GALR3HTR4DRD5ADRA1A
SCHEMBL917531 0.81 GALR3 (0.49) GALR3HTR4DRD5ADRA1A

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
US-8198313-B2 Use of GALR3 receptor antagonists for the treatment of depression and/or anxiety and compounds useful in such methods H. LUNDBECK A/S (DK) 2012-06-12 US disclosed
US-20110178125-A1 USE OF GALR3 RECEPTOR ANTAGONISTS FOR THE TREATMENT OF DEPRESSION AND/OR ANXIETY AND COMPOUNDS USEFUL IN SUCH METHODS KONKEL MICHAEL 2011-07-21 US disclosed
US-7868034-B2 Use of GALR3 receptor antagonists for the treatment of depression and/or anxiety and compounds useful in such methods H. LUNDBECK A/S (DK) 2011-01-11 US disclosed
US-20090176840-A1 USE OF GALR3 RECEPTOR ANTAGONISTS FOR THE TREATMENT OF DEPRESSION AND/OR ANXIETY AND COMPOUNDS USEFUL IN SUCH METHODS KONKEL MICHAEL 2009-07-09 US disclosed
US-20070054910-A1 Use of GALR3 receptor antagonists for the treatment of depression and/or anxiety and compounds useful in such methods KONKEL MICHAEL 2007-03-08 US 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 (3 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-20110178125-A1 USE OF GALR3 RECEPTOR ANTAGONISTS FOR THE TREATMENT OF DEPRESSION AND/OR ANXIETY AND COMPOUNDS USEFUL IN SUCH METHODS GALR3, GALR1, GALR2 GALR3 1/4885HTR4 30/4885DRD5 399/4885
US-20070054910-A1 Use of GALR3 receptor antagonists for the treatment of depression and/or anxiety and compounds useful in such methods GALR3, GALR1, GALR2 GALR3 1/4885HTR4 30/4885DRD5 399/4885
US-20090176840-A1 USE OF GALR3 RECEPTOR ANTAGONISTS FOR THE TREATMENT OF DEPRESSION AND/OR ANXIETY AND COMPOUNDS USEFUL IN SUCH METHODS GALR3, GALR1, GALR2 GALR3 1/4885HTR4 31/4885DRD5 399/4885

“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.