SCHEMBL3615459

SCHEMBL3615459

O=c1c2cnn(-c3ccccc3)c2ncn1C1C2CC3CC(C2)CC1C3

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.53
LMNA P02545 5/20 0.52
SMN1; SMN2 Q16637 4/20 0.52
KDM4E B2RXH2 3/20 0.52
HPGD P15428 2/20 0.52
POLB P06746 1/20 0.47
L3MBTL1 Q9Y468 2/20 0.45
MAPK1 P28482 2/20 0.44
TSHR P16473 1/20 0.44
HSD17B10 Q99714 2/20 0.44
MEN1 O00255 1/20 0.44
CYP1A2 P05177 1/20 0.44
ALPG P10696 1/20 0.44
KMT2A Q03164 1/20 0.44
ALDH1A1 P00352 2/20 0.43
HTT P42858 2/20 0.43
ALOX12 P18054 1/20 0.43
GRM1 Q13255 1/20 0.42
NPC1 O15118 1/20 0.42
DPP4 P27487 1/20 0.42

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
SCHEMBL13316476 1.00 RAB9A (0.53) RAB9ALMNASMN1; SMN2KDM4EHPGD
SCHEMBL3613073 0.83 RAB9A (0.53) RAB9ALMNASMN1; SMN2KDM4EHPGD
SCHEMBL8162771 0.83 RAB9A (0.48) RAB9ALMNASMN1; SMN2KDM4EHPGD
SCHEMBL3603582 0.79 GRM1 (0.59) RAB9ALMNASMN1; SMN2KDM4EHPGD
SCHEMBL3610908 0.78 GRM1 (0.61) RAB9ALMNASMN1; SMN2KDM4EHPGD
SCHEMBL3617841 0.77 RAB9A (0.57) RAB9ALMNASMN1; SMN2KDM4EHPGD
SCHEMBL13316474 0.73 RAB9A (0.47) RAB9ALMNASMN1; SMN2KDM4EHPGD
SCHEMBL20748041 0.72 RAB9A (0.64) RAB9ALMNASMN1; SMN2KDM4EHPGD
SCHEMBL8155383 0.70 RAB9A (0.48) RAB9ALMNASMN1; SMN2KDM4EHPGD
SCHEMBL8167154 0.70 RAB9A (0.51) RAB9ALMNASMN1; SMN2KDM4EHPGD

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
US-20100137340-A1 FUSED PYRIMIDINONE COMPOUNDS AS MGLUR LIGANDS GLATTHAR RALF 2010-06-03 US disclosed
EP-2132210-A1 FUSED PYRIMIDINONE COMPOUNDS AS MGLUR LIGANDS Novartis AG (CH) 2009-12-16 EP disclosed
WO-2008107418-A1 FUSED PYRIMIDINONE COMPOUNDS AS MGLUR LIGANDS NOVARTIS AG (CH) 2008-09-12 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-20100137340-A1 FUSED PYRIMIDINONE COMPOUNDS AS MGLUR LIGANDS GRM1, GRM2, GRM3 RAB9A 1068/4885LMNA 4440/4885SMN1; SMN2 1132/4885

“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.