SCHEMBL3634663

SCHEMBL3634663

CCn1c(-c2cnc(Nc3ccc(Cl)cc3)c(Cl)c2)nc2ccccc21

nearest known ligand 0.85

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 12/20 0.85
MAPT P10636 2/20 0.50
ALDH1A1 P00352 3/20 0.49
KDM4E B2RXH2 2/20 0.49
HPGD P15428 2/20 0.49
MEN1 O00255 1/20 0.45
NPC1 O15118 1/20 0.45
CYP1A2 P05177 1/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45
HTT P42858 1/20 0.45
RAB9A P51151 1/20 0.45
GFER P55789 1/20 0.45
KMT2A Q03164 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
TP53 P04637 1/20 0.44

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
SCHEMBL3635677 0.92 GRM5 (1.00) GRM5MAPTALDH1A1KDM4ENPSR1
SCHEMBL3635380 0.90 GRM5 (0.89) GRM5MAPTNPC1SMN1; SMN2TP53
SCHEMBL3636759 0.90 GRM5 (1.00) GRM5MAPTALDH1A1KDM4EHPGD
SCHEMBL3635144 0.89 GRM5 (0.82) GRM5MAPTALDH1A1KDM4EHPGD
SCHEMBL3631736 0.88 GRM5 (0.66) GRM5
SCHEMBL3632289 0.88 GRM5 (0.66) GRM5ALDH1A1NPC1RAB9A
SCHEMBL3636002 0.86 GRM5 (0.72) GRM5MAPTALDH1A1
SCHEMBL3635809 0.86 GRM5 (0.76) GRM5MAPTALDH1A1KDM4EMEN1
SCHEMBL3637910 0.85 GRM5 (0.89) GRM5MAPTALDH1A1KDM4EHPGD
SCHEMBL3635975 0.85 GRM5 (0.88) GRM5MAPTALDH1A1KDM4EHPGD

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 995/4885ALDH1A1 45/4885

“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.