SCHEMBL3633677

SCHEMBL3633677

CCCn1c(-c2ccc(Nc3ccc(Cl)cc3)c(Cl)c2)nc2cccc(Cl)c21

nearest known ligand 0.61

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 10/20 0.61
MAPT P10636 2/20 0.47
S1PR1 P21453 1/20 0.38
CASR P41180 2/20 0.37
ACP1 P24666 1/20 0.36
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
GAA P10253 1/20 0.35
TSHR P16473 1/20 0.35
NPSR1 Q6W5P4 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
SCHEMBL3634263 0.94 GRM5 (0.61) GRM5MAPTCASRACP1KDM4E
SCHEMBL3633806 0.90 GRM5 (0.58) GRM5MAPTCASRACP1KDM4E
SCHEMBL3635985 0.89 GRM5 (0.59) GRM5MAPTS1PR1CASRKDM4E
SCHEMBL3634276 0.88 GRM5 (0.79) GRM5MAPTCASRKDM4ELMNA
SCHEMBL3632286 0.86 GRM5 (0.82) GRM5MAPTS1PR1
SCHEMBL3629201 0.82 GRM5 (0.60) GRM5MAPTS1PR1
SCHEMBL3634721 0.82 GRM5 (0.59) GRM5MAPTCASRKDM4EALDH1A1
SCHEMBL3632235 0.82 GRM5 (0.62) GRM5MAPTS1PR1ALDH1A1
SCHEMBL3633369 0.79 GRM5 (0.55) GRM5MAPTCASRKDM4EALDH1A1
SCHEMBL3633601 0.79 KDM4E (0.58) GRM5MAPTCASRKDM4EALDH1A1

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 995/4885S1PR1 3425/4885

“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.