SCHEMBL839657

SCHEMBL839657

Cc1ccccc1-n1ncc2c(Cl)ncnc21

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 1/20 0.54
SLC2A2 P11168 1/20 0.54
SLC2A3 P11169 1/20 0.54
GSK3B P49841 1/20 0.52
TP53 P04637 10/20 0.50
FSCN1 Q16658 1/20 0.48
GRM5 P41594 1/20 0.48
GRM1 Q13255 1/20 0.48
RAB9A P51151 2/20 0.48
LMNA P02545 6/20 0.47
MAPT P10636 5/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
HTT P42858 2/20 0.47
NPC1 O15118 1/20 0.47
TSHR P16473 1/20 0.47
HSD17B10 Q99714 1/20 0.47
POLB P06746 2/20 0.47
ALDH1A1 P00352 2/20 0.46
NPSR1 Q6W5P4 2/20 0.46
KDM4E B2RXH2 1/20 0.46

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
SCHEMBL3424926 0.89 TP53 (0.54) SLC2A1SLC2A2SLC2A3GSK3BTP53
SCHEMBL8344611 0.85 SLC2A1 (0.56) SLC2A1SLC2A2SLC2A3GSK3BTP53
SCHEMBL839210 0.85 GCK (0.47) SLC2A1SLC2A2SLC2A3TP53RAB9A
SCHEMBL838694 0.83 CYP17A1 (0.46) GSK3BTP53RAB9ALMNAMAPT
SCHEMBL838498 0.83 RAB9A (0.46) GSK3BTP53RAB9ALMNAMAPT
SCHEMBL838336 0.83 TP53 (0.41) SLC2A1SLC2A2SLC2A3GSK3BTP53
SCHEMBL839442 0.83 TP53 (0.46) SLC2A1SLC2A2SLC2A3TP53FSCN1
SCHEMBL839601 0.83 RAB9A (0.55) TP53RAB9ALMNAMAPTHTT
SCHEMBL12000946 0.82 SLC2A1 (0.53) SLC2A1SLC2A2SLC2A3TP53RAB9A
SCHEMBL6253182 0.82 MAPT (0.47) SLC2A1SLC2A2SLC2A3TP53RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8143263-B2 Therapeutic agents ASTRAZENECA AB (SE) 2012-03-27 US disclosed
US-8143263-B2 Therapeutic agents ASTRAZENECA AB (SE) 2012-03-27 US disclosed
US-8143263-B2 Therapeutic agents ASTRAZENECA AB (SE) 2012-03-27 US disclosed
US-20100093757-A1 THERAPEUTIC AGENTS 414 ASTRAZENECA AB (SE) 2010-04-15 US disclosed
US-20100093757-A1 THERAPEUTIC AGENTS 414 ASTRAZENECA AB (SE) 2010-04-15 US disclosed
US-20100093757-A1 THERAPEUTIC AGENTS 414 ASTRAZENECA AB (SE) 2010-04-15 US disclosed
WO-2010015849-A2 THERAPEUTIC AGENTS 414 ASTRAZENECA AB (SE) 2010-02-11 WO disclosed
WO-2005047288-A1 PYRAZOLOPYRIMIDINES AS ANTI - HEPATITS C AGENTS ARROW THERAPEUTICS LIMITED (GB) 2005-05-26 WO disclosed
WO-2004009602-A1 PYRAZOLOPYRIMIDINES AS KINASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2004-01-29 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-20100093757-A1 THERAPEUTIC AGENTS 414 GCK, GCKR, GPR119 SLC2A1 14/4885SLC2A2 22/4885SLC2A3 17/4885

“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.