SCHEMBL6922019

SCHEMBL6922019

COCCn1cnc2cc(-c3cccnc3)ccc2c1=O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 1/20 0.51
KMT2A Q03164 3/20 0.46
LMNA P02545 2/20 0.46
ALDH1A1 P00352 2/20 0.46
MEN1 O00255 2/20 0.46
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
HIF1A Q16665 1/20 0.46
HSD17B10 Q99714 1/20 0.46
CLK4 Q9HAZ1 1/20 0.46
GRK2 P25098 1/20 0.46
GRK1 Q15835 1/20 0.46
P2RX3 P56373 2/20 0.45
ROCK2 O75116 2/20 0.43
RAB9A P51151 1/20 0.43
MAPK1 P28482 3/20 0.43
MAPT P10636 2/20 0.43
HTT P42858 2/20 0.43
GAA P10253 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL12059746 0.86 GRK2 (0.50) KMT2ALMNAALDH1A1MEN1GRK2
SCHEMBL2053573 0.82 MAPT (0.45) KMT2ALMNAALDH1A1MEN1RAB9A
SCHEMBL6922249 0.81 MAPT (0.46) KMT2ALMNAALDH1A1MEN1CYP1A2
SCHEMBL24166042 0.76 TNF (0.61) KMT2ALMNAALDH1A1MEN1HSD17B10
SCHEMBL6921490 0.76 LMNA (0.54) KMT2ALMNAALDH1A1MEN1RAB9A
SCHEMBL30656848 0.75 CLK1 (0.43) GRM2KMT2ALMNAALDH1A1MEN1
SCHEMBL24166121 0.75 CLK1 (0.43) GRM2KMT2ALMNAALDH1A1MEN1
SCHEMBL6923231 0.74 MAPT (0.45) KMT2ALMNAALDH1A1MEN1RAB9A
SCHEMBL17260448 0.74 GRK2 (0.49) KMT2ALMNAALDH1A1MEN1CYP1A2
SCHEMBL26758103 0.72 MAPT (0.74) KMT2ALMNAALDH1A1MEN1RAB9A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110319380-A1 Compounds for Treating Disorders Mediated by Metabotropic Glutamate Receptor 5, and Methods of Use Thereof SUNOVION PHARMACEUTICALS INC. (US) 2011-12-29 US disclosed
WO-2011075699-A2 COMPOUNDS FOR TREATING DISORDERS MEDIATED BY METABOTROPIC GLUTAMATE RECEPTOR 5, AND METHODS OF USE THEREOF SUNOVION PHARMACEUTICALS INC. (US) 2011-06-23 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-20110319380-A1 Compounds for Treating Disorders Mediated by Metabotropic Glutamate Receptor 5, and Methods of Use Thereof GRM5, GRM2, GRM1 GRM2 2/4885KMT2A 944/4885LMNA 4613/4885

“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.