SCHEMBL14022320

SCHEMBL14022320

COCCCNC(=O)c1ccnc2[nH]c(-c3ccc(S(C)(=O)=O)cc3)nc12

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.45
HSD17B10 Q99714 2/20 0.45
ALDH1A1 P00352 2/20 0.45
HPGD P15428 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
GAA P10253 1/20 0.42
MAPT P10636 4/20 0.41
GSK3B P49841 7/20 0.40
TP53 P04637 1/20 0.39
PARP1 P09874 1/20 0.39
CCNE2 O96020 1/20 0.39
CCNE1 P24864 1/20 0.39
CDK2 P24941 1/20 0.39
CA2 P00918 1/20 0.38
CA4 P22748 1/20 0.38
RAD52 P43351 1/20 0.38
UHRF1 Q96T88 1/20 0.38
MEN1 O00255 1/20 0.38
APAF1 O14727 1/20 0.38
NPC1 O15118 1/20 0.38

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
Hydrochloric Acid SCHEMBL4904830 0.99 KDM4E (0.44) KDM4EHSD17B10ALDH1A1HPGDSMN1; SMN2
SCHEMBL14022321 0.89 KDM4E (0.44) KDM4EHSD17B10ALDH1A1HPGDSMN1; SMN2
Hydrochloric Acid SCHEMBL4913699 0.88 KDM4E (0.44) KDM4EHSD17B10ALDH1A1HPGDSMN1; SMN2
SCHEMBL14022278 0.87 TP53 (0.52) KDM4EHSD17B10ALDH1A1HPGDSMN1; SMN2
SCHEMBL14022301 0.86 CCNE2 (0.50) KDM4EALDH1A1SMN1; SMN2GAAMAPT
SCHEMBL14022317 0.86 ADORA2B (0.41) KDM4EHSD17B10ALDH1A1HPGDSMN1; SMN2
SCHEMBL4899824 0.86 ALDH1A1 (0.45) KDM4EHSD17B10ALDH1A1HPGDSMN1; SMN2
Hydrochloric Acid SCHEMBL4905640 0.86 ADORA2B (0.41) KDM4EHSD17B10ALDH1A1GAAMAPT
Hydrochloric Acid SCHEMBL4911054 0.86 CCNE2 (0.49) KDM4EALDH1A1SMN1; SMN2GAAMAPT
SCHEMBL14022302 0.85 GSK3B (0.59) KDM4EALDH1A1GAAMAPTGSK3B

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-20080255106-A1 Novel 2-Phenyl-Imidazo[4,5-B]Pyridine Derivatives as Inhibitors of Glycogen Synthase Kinase for the Treatment of Dementia and Neurodegenerative Disorders ASTRAZENECA AB (SE) 2008-10-16 US disclosed
US-20080255106-A1 Novel 2-Phenyl-Imidazo[4,5-B]Pyridine Derivatives as Inhibitors of Glycogen Synthase Kinase for the Treatment of Dementia and Neurodegenerative Disorders ASTRAZENECA AB (SE) 2008-10-16 US disclosed
WO-2007040439-A1 NEW COMPOUNDS II ASTRAZENECA AB (SE) 2007-04-12 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-20080255106-A1 Novel 2-Phenyl-Imidazo[4,5-B]Pyridine Derivatives as Inhibitors of Glycogen Synthase Kinase for the Treatment of Dementia and Neurodegenerative Disorders GSK3B, PYGB, GSK3A KDM4E 793/4885HSD17B10 1678/4885ALDH1A1 3515/4885

“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.