SCHEMBL3602075

SCHEMBL3602075

O=c1c2cnn(-c3cccnc3)c2ncn1-c1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.62
RAB9A P51151 3/20 0.54
LMNA P02545 5/20 0.53
SMN1; SMN2 Q16637 5/20 0.53
HPGD P15428 3/20 0.53
KDM4E B2RXH2 3/20 0.53
HSD17B10 Q99714 3/20 0.50
HTT P42858 2/20 0.50
PKM P14618 1/20 0.50
GRM1 Q13255 1/20 0.49
ALDH1A1 P00352 3/20 0.47
CYP1A2 P05177 2/20 0.47
CYP2D6 P10635 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.46
DPP4 P27487 1/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
ALPG P10696 1/20 0.45
TSHR P16473 1/20 0.45
MAPK1 P28482 1/20 0.45

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
SCHEMBL3612174 0.88 RAB9A (0.59) POLBRAB9ALMNASMN1; SMN2HPGD
SCHEMBL3614046 0.82 LMNA (0.55) POLBRAB9ALMNASMN1; SMN2HPGD
SCHEMBL3615612 0.82 LMNA (0.60) POLBRAB9ALMNASMN1; SMN2HPGD
SCHEMBL3612236 0.82 RAB9A (0.61) POLBRAB9ALMNASMN1; SMN2HPGD
SCHEMBL3616124 0.81 SMN1; SMN2 (0.65) RAB9ALMNASMN1; SMN2HPGDKDM4E
SCHEMBL3608848 0.80 RAB9A (0.55) RAB9ALMNASMN1; SMN2HPGDKDM4E
SCHEMBL16268721 0.80 RAB9A (0.77) POLBRAB9ALMNASMN1; SMN2HPGD
SCHEMBL3613365 0.78 SMN1; SMN2 (0.68) POLBRAB9ALMNASMN1; SMN2HPGD
SCHEMBL3597543 0.78 SMN1; SMN2 (0.52) POLBRAB9ALMNASMN1; SMN2HPGD
SCHEMBL3612259 0.78 FSCN1 (0.54) POLBRAB9ALMNASMN1; SMN2HPGD

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 POLB 4500/4885RAB9A 1068/4885LMNA 4440/4885

“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.