SCHEMBL10314929

SCHEMBL10314929

O=C1c2cc(OCc3ccccc3)cnc2CCN1c1cccnc1

nearest known ligand 0.59

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 5/20 0.59
CYP11B2 P19099 7/20 0.47
CYP11B1 P15538 6/20 0.47
MAPT P10636 1/20 0.43
CYP19A1 P11511 3/20 0.42
SNRNP200 O75643 1/20 0.42

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
SCHEMBL10314877 0.91 GRM5 (0.48) GRM5
SCHEMBL10314895 0.84 GRM5 (0.50) GRM5
SCHEMBL10314889 0.84 GRM5 (0.48) GRM5
SCHEMBL10314930 0.84 GRM5 (0.59) GRM5
SCHEMBL10008519 0.84 GRM5 (0.55) GRM5MAPT
SCHEMBL10314892 0.80 GRM5 (0.48) GRM5
SCHEMBL10008711 0.79 GRM5 (0.55) GRM5
SCHEMBL10314891 0.78 GRM5 (0.52) GRM5
SCHEMBL16151981 0.78 GRM5 (0.60) GRM5
SCHEMBL16151982 0.78 GRM5 (0.46) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8853237-B2 Naphthyridinone analogs as mGluR5 positive allosteric modulators VANDERBILT UNIVERSITY (US) 2014-10-07 US disclosed
US-8853237-B2 Naphthyridinone analogs as mGluR5 positive allosteric modulators VANDERBILT UNIVERSITY (US) 2014-10-07 US disclosed
US-20120172391-A1 NAPHTHYRIDINONE ANALOGS AS MGLUR5 POSITIVE ALLOSTERIC MODULATORS NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR 2012-07-05 US disclosed
US-20120172391-A1 NAPHTHYRIDINONE ANALOGS AS MGLUR5 POSITIVE ALLOSTERIC MODULATORS NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR 2012-07-05 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 (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-20120172391-A1 NAPHTHYRIDINONE ANALOGS AS MGLUR5 POSITIVE ALLOSTERIC MODULATORS GRM5, GRIK5, GRM1 GRM5 1/4885CYP11B2 2221/4885CYP11B1 2155/4885

“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.