SCHEMBL2893797

SCHEMBL2893797

O=C(O)N1CC=C(c2cn(-c3cccnc3Cl)nn2)CC1

nearest known ligand 0.58

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GRM1 Q13255 16/20 0.58
GRM5 P41594 13/20 0.58
ALDH1A1 P00352 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
HRH1 P35367 1/20 0.38
TMEM97 Q5BJF2 1/20 0.38
TRPV1 Q8NER1 2/20 0.38
PTGS2 P35354 1/20 0.36

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
SCHEMBL2892061 0.87 GRM1 (0.74) GRM1GRM5ALDH1A1SMN1; SMN2HRH1
SCHEMBL2893490 0.86 GRM1 (0.62) GRM1GRM5HRH1TMEM97
SCHEMBL2891696 0.86 GRM1 (0.57) GRM1GRM5ALDH1A1SMN1; SMN2
SCHEMBL2891023 0.85 GRM1 (0.59) GRM1GRM5HRH1TMEM97TRPV1
SCHEMBL2892779 0.85 GRM1 (0.59) GRM1GRM5HRH1TMEM97TRPV1
SCHEMBL2892959 0.85 GRM1 (0.72) GRM1GRM5TRPV1
SCHEMBL2892663 0.85 GRM1 (0.61) GRM1GRM5ALDH1A1SMN1; SMN2HRH1
SCHEMBL2889101 0.85 GRM1 (0.73) GRM1GRM5
SCHEMBL5489535 0.85 GRM1 (0.55) GRM1GRM5ALDH1A1SMN1; SMN2HRH1
SCHEMBL2889071 0.84 GRM1 (0.53) GRM1GRM5HRH1TMEM97TRPV1

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
CN-1980901-A Biaryl derivatives BANYU PHARMA CO LTD (JP) 2007-06-13 CN claimed
US-7858800-B2 Biaryl derivatives BANYU PHARMACEUTICAL CO., LTD. (JP) 2010-12-28 US disclosed
US-20070191389-A1 Biaryl derivatives BANYU PHARMACEUTICAL CO., LTD. (JP) 2007-08-16 US disclosed
CN-1980901-A Biaryl derivatives BANYU PHARMA CO LTD (JP) 2007-06-13 CN disclosed
EP-1764362-A1 BIARYL DERIVATIVES BANYU PHARMACEUTICAL CO., LTD. (JP) 2007-03-21 EP 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-20070191389-A1 Biaryl derivatives GRM1, GRIN1, GRIN2B GRM1 1/4885GRM5 26/4885ALDH1A1 712/4885

“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.