SCHEMBL5673102

SCHEMBL5673102

Cc1cc(CO)nc(-n2c(C)ccc2C)c1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 2/20 0.33
S1PR2 O95136 1/20 0.33
GRIN2D O15399 1/20 0.32
GRIN3B O60391 1/20 0.32
CHRM1 P11229 1/20 0.32
ADRA1D P25100 1/20 0.32
ADRA1A P35348 1/20 0.32
ADRA1B P35368 1/20 0.32
GRIN1 Q05586 1/20 0.32
GRIN2A Q12879 1/20 0.32
GRIN2B Q13224 1/20 0.32
GRIN2C Q14957 1/20 0.32
GRIN3A Q8TCU5 1/20 0.32
POLB P06746 1/20 0.32
MAPT P10636 1/20 0.32
MYC P01106 1/20 0.32
NOS2 P35228 3/20 0.32
NOS3 P29474 1/20 0.32
CCR1 P32246 1/20 0.31
KDM4E B2RXH2 1/20 0.31

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
SCHEMBL5672155 0.86 NOS2 (0.36) NOS2NOS3NOS1
SCHEMBL8326929 0.84 NOS2 (0.48) GRIN2DGRIN3BCHRM1ADRA1DADRA1A
SCHEMBL6164525 0.82 NOS2 (0.39) NOS2NOS3NOS1
SCHEMBL2773550 0.82 MYC (0.32) MYCNOS2NOS3CCR1KDM4E
SCHEMBL5930653 0.82 SMN1; SMN2 (0.36) NOS2NOS3KDM4EALDH1A1L3MBTL1
SCHEMBL13040592 0.81 NOS2 (0.54) NOS2NOS3KDM4ENOS1
SCHEMBL6167004 0.81 NOS2 (0.38) NOS2NOS3NOS1
SCHEMBL13040655 0.81 NOS2 (0.38) NOS2NOS3NOS1
SCHEMBL8328137 0.81 NOS2 (0.51) MAPTNOS2NOS3KDM4EALDH1A1
SCHEMBL2776731 0.81 KDM4E (0.33) MAPTNOS2NOS3KDM4EALDH1A1

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-20060194847-A1 Novel 6-substituted 2-aminopyridine derivatives ASTRAZENECA AB (SE) 2006-08-31 US disclosed
EP-1611099-A1 NOVEL 6-SUBSTITUTED 2-AMINOPYRIDINE DERIVATIVES AstraZeneca AB (SE) 2006-01-04 EP disclosed
WO-2004087665-A1 NOVEL 6-SUBSTITUTED 2-AMINOPYRIDINE DERIVATIVES ASTRAZENECA AB (SE) 2004-10-14 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-20060194847-A1 Novel 6-substituted 2-aminopyridine derivatives NOS1, NOS2, NOS3 NOTUM 2877/4885S1PR2 2417/4885GRIN2D 255/4885

“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.