SCHEMBL5078978

SCHEMBL5078978

COc1cccc(Nc2ncccc2C(N)=O)c1

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 7/20 0.79
KMT2A Q03164 7/20 0.79
HTT P42858 2/20 0.79
MAPK1 P28482 2/20 0.79
PKM P14618 1/20 0.79
MAPT P10636 7/20 0.72
LMNA P02545 1/20 0.67
ALDH1A1 P00352 5/20 0.65
POLB P06746 1/20 0.65
RAB9A P51151 5/20 0.61
NPC1 O15118 4/20 0.61
KCNH2 Q12809 1/20 0.61
SMN1; SMN2 Q16637 2/20 0.60
AHR P35869 1/20 0.60
MAP4K2 Q12851 1/20 0.58
NPSR1 Q6W5P4 2/20 0.57
SYK P43405 5/20 0.57
PDE4B Q07343 2/20 0.57
GAA P10253 1/20 0.55
EGFR P00533 1/20 0.54

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
SCHEMBL16627430 0.88 MEN1 (0.81) MEN1KMT2AHTTMAPK1PKM
SCHEMBL7281318 0.88 MEN1 (0.81) MEN1KMT2AHTTMAPK1PKM
SCHEMBL5079789 0.84 LMNA (0.66) MEN1KMT2AHTTMAPK1PKM
SCHEMBL5250412 0.84 LMNA (0.65) MEN1KMT2AHTTMAPK1PKM
SCHEMBL5083062 0.83 RAB9A (0.72) MEN1KMT2AHTTMAPK1PKM
SCHEMBL28282946 0.81 LMNA (0.73) MEN1KMT2AHTTMAPK1PKM
SCHEMBL9496511 0.80 LMNA (1.00) MEN1KMT2AHTTMAPK1PKM
SCHEMBL5255345 0.80 LMNA (0.71) MEN1KMT2AHTTMAPK1PKM
SCHEMBL28949487 0.80 LMNA (0.71) MEN1KMT2AHTTMAPK1PKM
SCHEMBL29898238 0.80 LMNA (0.71) MEN1KMT2AHTTMAPK1PKM

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
CN-106061967-B The nicotinamide compounds replaced through heteroaryl 百时美施贵宝公司 2019-04-19 CN claimed
US-20080132505-A1 Combination Of Cb2 Modulators And Pde4 Inhibitors For Use In Medicine GLAXO GROUP LIMITED 2008-06-05 US 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-20080132505-A1 Combination Of Cb2 Modulators And Pde4 Inhibitors For Use In Medicine CNR2, CNR1, PDE4A MEN1 3868/4885KMT2A 2846/4885HTT 4329/4885

“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.