SCHEMBL3635787

SCHEMBL3635787

CCCn1c(-c2cnc(Nc3ccc(C#N)cc3)c(Cl)c2)nc2cccc(Cl)c21

nearest known ligand 0.75

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 12/20 0.75
CYP11B2 P19099 2/20 0.39
ABCG2 Q9UNQ0 2/20 0.38
PSMB8 P28062 1/20 0.37
PDE4B Q07343 1/20 0.37
PDE4D Q08499 1/20 0.37
GPR6 P46095 1/20 0.36
CYP11B1 P15538 1/20 0.36
MAPT P10636 1/20 0.35

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
SCHEMBL3632286 0.90 GRM5 (0.82) GRM5MAPT
SCHEMBL3633409 0.89 GRM5 (0.79) GRM5PSMB8MAPT
SCHEMBL3635831 0.88 GRM5 (0.82) GRM5CYP11B1MAPT
SCHEMBL3634911 0.87 GRM5 (0.78) GRM5
SCHEMBL3634762 0.86 GRM5 (0.77) GRM5MAPT
SCHEMBL3633520 0.86 GRM5 (1.00) GRM5
SCHEMBL3633595 0.84 GRM5 (0.77) GRM5ABCG2MAPT
SCHEMBL3635835 0.84 GRM5 (0.77) GRM5ABCG2MAPT
SCHEMBL3634654 0.84 GRM5 (0.76) GRM5ABCG2
SCHEMBL3635543 0.83 GRM5 (0.78) GRM5MAPT

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
EP-2146969-A1 NICOTINIC ACID DERIVATIVES AS MODULATORS OF METABOTROPIC GLUTAMATE RECEPTOR-5 Novartis Ag (CH) 2010-01-27 EP disclosed
US-20090105266-A1 Organic compounds NOVARTIS AG (CH) 2009-04-23 US disclosed
WO-2008128968-A1 NICOTINIC ACID DERIVATIVES AS MODULATORS OF METABOTROPIC GLUTAMATE RECEPTOR-5 NOVARTIS AG (CH) 2008-10-30 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-20090105266-A1 Organic compounds SLCO2B1, SLCO1B1, SLCO1B3 GRM5 4545/4885CYP11B2 38/4885ABCG2 22/4885

“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.