SCHEMBL14153307

SCHEMBL14153307

N/C(=N\O)c1ccc(C#Cc2ccncc2)cn1

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 7/20 0.51
CHRM2 P08172 1/20 0.51
SIGMAR1 Q99720 1/20 0.51
FLT3 P36888 1/20 0.36
FFAR1 O14842 1/20 0.36
KDM1A O60341 1/20 0.33

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
SCHEMBL15913454 0.80 FFAR1 (0.42) GRM5FFAR1
SCHEMBL14153234 0.80 FFAR1 (0.42) GRM5FFAR1
SCHEMBL14061857 0.78 FLT3 (0.45) GRM5FLT3FFAR1KDM1A
SCHEMBL14153032 0.78 FLT3 (0.45) GRM5FLT3FFAR1KDM1A
SCHEMBL3392810 0.77 KMT2A (0.32) GRM5CHRM2SIGMAR1FLT3
SCHEMBL3392808 0.77 KMT2A (0.32) GRM5CHRM2SIGMAR1FLT3
SCHEMBL17395190 0.77 NOS3 (0.38)
SCHEMBL5223201 0.77 NOS3 (0.38)
SCHEMBL15913884 0.76 GRM5 (0.55) GRM5
SCHEMBL14153545 0.76 GRM5 (0.55) GRM5

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
US-20140221332-A1 METABOTROPHIC GLUTAMATE RECEPTOR 5 MODULATORS AND METHODS OF USE THEREOF SUNOVION PHARMACEUTICALS INC. (US) 2014-08-07 US disclosed
US-20140221332-A1 METABOTROPHIC GLUTAMATE RECEPTOR 5 MODULATORS AND METHODS OF USE THEREOF SUNOVION PHARMACEUTICALS INC. (US) 2014-08-07 US disclosed
WO-2012162635-A1 METABOTROPIC GLUTAMATE RECEPTORS 5 MODULATORS AND METHODS OF USE THEREOF SUNOVION PHARMACEUTICALS INC. (US) 2012-11-29 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-20140221332-A1 METABOTROPHIC GLUTAMATE RECEPTOR 5 MODULATORS AND METHODS OF USE THEREOF GRM5, GRIK5, GRM2 GRM5 1/4885CHRM2 591/4885SIGMAR1 251/4885

“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.