SCHEMBL3634995

SCHEMBL3634995

CCCn1c(-c2cnc(Nc3ccc(C)nc3)c(Cl)c2)nc2cc(F)c(F)cc21

nearest known ligand 0.78

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 17/20 0.78
CYP11B2 P19099 2/20 0.48
KDM4E B2RXH2 1/20 0.41
LMNA P02545 1/20 0.41

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
SCHEMBL3632582 0.91 GRM5 (0.81) GRM5KDM4ELMNA
SCHEMBL3632240 0.91 GRM5 (0.86) GRM5CYP11B2
SCHEMBL3630119 0.91 GRM5 (0.82) GRM5KDM4ELMNA
SCHEMBL3631210 0.91 GRM5 (0.82) GRM5KDM4ELMNA
SCHEMBL3634778 0.88 GRM5 (0.86) GRM5KDM4ELMNA
SCHEMBL3635987 0.88 GRM5 (0.81) GRM5
SCHEMBL3634251 0.88 GRM5 (1.00) GRM5KDM4ELMNA
SCHEMBL3634424 0.88 GRM5 (0.86) GRM5
SCHEMBL3636026 0.87 GRM5 (1.00) GRM5KDM4ELMNA
SCHEMBL3634661 0.86 GRM5 (0.81) 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
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 38/4885KDM4E 2938/4885

“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.