SCHEMBL3633643

SCHEMBL3633643

CCCn1c(-c2cnc(Cl)nc2)nc2cccc(Cl)c21

nearest known ligand 0.61

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 7/20 0.61
MAPT P10636 1/20 0.41
PRMT5 O14744 1/20 0.41
KDM4E B2RXH2 3/20 0.40
LMNA P02545 2/20 0.40
ALDH1A1 P00352 2/20 0.40
GAA P10253 1/20 0.40
TSHR P16473 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
PSMB8 P28062 1/20 0.39
CASR P41180 2/20 0.39
CYP11B1 P15538 1/20 0.37
ADORA2B P29275 1/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
TP53 P04637 1/20 0.36
HPGD P15428 1/20 0.36
HTT P42858 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
SCHEMBL3632524 0.87 GRM5 (0.59) GRM5MAPTPRMT5KDM4ELMNA
SCHEMBL3633793 0.86 GRM5 (0.66) GRM5MAPTPRMT5KDM4ELMNA
SCHEMBL3632235 0.83 GRM5 (0.62) GRM5MAPTALDH1A1
SCHEMBL3636267 0.81 GRM5 (0.77) GRM5MAPTKDM4ELMNANPSR1
SCHEMBL3634249 0.81 GRM5 (0.60) GRM5MAPTKDM4ELMNAALDH1A1
Hydrochloric Acid SCHEMBL3633719 0.81 GRM5 (0.52) GRM5MAPTPRMT5KDM4ELMNA
SCHEMBL3635765 0.80 GRM5 (0.58) GRM5MAPTKDM4ELMNAALDH1A1
SCHEMBL3637528 0.79 GRM5 (0.60) GRM5MAPTKDM4ELMNAALDH1A1
SCHEMBL3629201 0.79 GRM5 (0.60) GRM5MAPT
Ammonia Solution, Strong SCHEMBL3664527 0.79 GRM5 (0.58) GRM5MAPTPRMT5KDM4ELMNA

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 4545/4885MAPT 995/4885PRMT5 2809/4885

“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.