SCHEMBL8307140

SCHEMBL8307140

CCOc1cccnc1Nc1ccc(C)cn1

nearest known ligand 0.69

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 15/20 0.69
ASIC3 Q9UHC3 1/20 0.45
KDM4E B2RXH2 2/20 0.44
HTT P42858 2/20 0.43
KMT2A Q03164 2/20 0.43
MEN1 O00255 1/20 0.43
PDE10A Q9Y233 1/20 0.43
HPGD P15428 1/20 0.42
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.42
ALOX12 P18054 1/20 0.42
L3MBTL1 Q9Y468 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
SCHEMBL16264688 0.85 GRM5 (0.61) GRM5ASIC3KDM4EKMT2AMEN1
SCHEMBL5582608 0.82 GRM5 (1.00) GRM5ASIC3HTTKMT2AMEN1
SCHEMBL5582696 0.77 GRM5 (1.00) GRM5ASIC3
SCHEMBL5582909 0.72 GRM5 (1.00) GRM5ASIC3
SCHEMBL27311239 0.71 SLC2A1 (0.50) KDM4EKMT2AMEN1PDE10AALDH1A1
SCHEMBL5582626 0.70 GRM5 (1.00) GRM5ASIC3
SCHEMBL21666863 0.70 RAB9A (0.59) KDM4EKMT2AMEN1HPGDALDH1A1
SCHEMBL15779673 0.70 SLC2A1 (0.56) KDM4EHTTKMT2AMEN1PDE10A
SCHEMBL29533207 0.70 BTK (0.46) KDM4EKMT2AMEN1
SCHEMBL20260151 0.69 GRM5 (0.61) GRM5ASIC3HTTKMT2AMEN1

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-20070027321-A1 Bipyridyl amines and ethers as modulators of metabotropic glutamate receptor-5 MERCK SHARP & DOHME CORP. 2007-02-01 US disclosed
US-20070027321-A1 Bipyridyl amines and ethers as modulators of metabotropic glutamate receptor-5 MERCK SHARP & DOHME CORP. 2007-02-01 US disclosed
WO-2005021529-A1 BIPYRIDYL AMINES AND ETHERS AS MODULATORS OF METABOTROPIC GLUTAMATE RECEPTOR-5 MERCK & CO., INC. (US) 2005-03-10 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-20070027321-A1 Bipyridyl amines and ethers as modulators of metabotropic glutamate receptor-5 GRM5, GRIK5, GRM1 GRM5 1/4885ASIC3 366/4885KDM4E 327/4885

“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.